3,5-Dimethyl 4-[2-chloro-6-[4-(methoxycarbonyl)-2,5-dimethyl-3-furanyl]-3-quinolinyl]-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H27ClN2O7
Molecular Weight	538.976
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-Dimethyl 4-[2-chloro-6-[4-(methoxycarbonyl)-2,5-dimethyl-3-furanyl]-3-quinolinyl]-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate

Structure Search

SMILES

COC(=O)C1=C(C)OC(C)=C1C2=CC3=CC(C4C(C(=O)OC)=C(C)NC(C)=C4C(=O)OC)=C(Cl)N=C3C=C2

InChI

InChIKey=YNOHXMCFGACTGL-UHFFFAOYSA-N

InChI=1S/C28H27ClN2O7/c1-12-20(26(32)35-5)24(21(13(2)30-12)27(33)36-6)18-11-17-10-16(8-9-19(17)31-25(18)29)22-14(3)38-15(4)23(22)28(34)37-7/h8-11,24,30H,1-7H3

HIDE SMILES / InChI

Molecular Formula	C28H27ClN2O7
Molecular Weight	538.976
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 `Mon Mar 31 21:04:32 GMT 2025` Edited by `admin` on `Mon Mar 31 21:04:32 GMT 2025`
Record UNII	KCP7WKG3TK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,5-Pyridinedicarboxylic acid, 4-[2-chloro-6-[4-(methoxycarbonyl)-2,5-dimethyl-3-furanyl]-3-quinolinyl]-1,4-dihydro-2,6-dimethyl-, 3,5-dimethyl ester

Preferred Name

English

3,5-Dimethyl 4-[2-chloro-6-[4-(methoxycarbonyl)-2,5-dimethyl-3-furanyl]-3-quinolinyl]-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate

Systematic Name

English

Code System Code Type Description

FDA UNII

KCP7WKG3TK

Created by admin on Mon Mar 31 21:04:32 GMT 2025 , Edited by admin on Mon Mar 31 21:04:32 GMT 2025

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PUBCHEM

3078493

Created by admin on Mon Mar 31 21:04:32 GMT 2025 , Edited by admin on Mon Mar 31 21:04:32 GMT 2025

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CAS

121497-12-9

Created by admin on Mon Mar 31 21:04:32 GMT 2025 , Edited by admin on Mon Mar 31 21:04:32 GMT 2025

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EPA CompTox

DTXSID80153280

Created by admin on Mon Mar 31 21:04:32 GMT 2025 , Edited by admin on Mon Mar 31 21:04:32 GMT 2025

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