3-[2-[Bis(phenylmethyl)amino]ethyl] 5-(1-methylethyl) 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate hydrochloride

Details

Stereochemistry	RACEMIC
Molecular Formula	C32H33N3O6.ClH
Molecular Weight	592.082
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-[2-[Bis(phenylmethyl)amino]ethyl] 5-(1-methylethyl) 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate hydrochloride

Structure Search

SMILES

Cl.COC(=O)C1=C(C)NC(C)=C(C1C2=CC(=CC=C2)[N+]([O-])=O)C(=O)OCCN(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChIKey=QENGRFJGISLBGI-UHFFFAOYSA-N

InChI=1S/C32H33N3O6.ClH/c1-22-28(31(36)40-3)30(26-15-10-16-27(19-26)35(38)39)29(23(2)33-22)32(37)41-18-17-34(20-24-11-6-4-7-12-24)21-25-13-8-5-9-14-25;/h4-16,19,30,33H,17-18,20-21H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula	C32H33N3O6
Molecular Weight	555.6209
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:24:06 GMT 2025` Edited by `admin` on `Wed Apr 02 20:24:06 GMT 2025`
Record UNII	V6T3KQN4HF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-[2-[Bis(phenylmethyl)amino]ethyl] 5-(1-methylethyl) 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate hydrochloride

Systematic Name

English

3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 2-[bis(phenylmethyl)amino]ethyl 1-methylethyl ester, monohydrochloride

Preferred Name

English

3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 3-[2-[bis(phenylmethyl)amino]ethyl] 5-(1-methylethyl) ester, hydrochloride

Systematic Name

English

3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 3-[2-[bis(phenylmethyl)amino]ethyl] 5-(1-methylethyl) ester, hydrochloride (1:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

171390228

Created by admin on Wed Apr 02 20:24:06 GMT 2025 , Edited by admin on Wed Apr 02 20:24:06 GMT 2025

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FDA UNII

V6T3KQN4HF

Created by admin on Wed Apr 02 20:24:06 GMT 2025 , Edited by admin on Wed Apr 02 20:24:06 GMT 2025

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CAS

71791-89-4

Created by admin on Wed Apr 02 20:24:06 GMT 2025 , Edited by admin on Wed Apr 02 20:24:06 GMT 2025

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Related Record Type Details


					EXQ6PS6G7H

3-[2-[Bis(phenylmethyl)amino]ethyl] 5-(1-methylethyl) 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate

SALT/SOLVATE -> PARENT

Amount: