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=CC=C3N=C(Cl)C(=CC3=C2)C4C(C(=O)OC)=C(C)NC(C)=C4C(=O)OC

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 `Sat Dec 16 01:55:37 GMT 2023` Edited by `admin` on `Sat Dec 16 01:55:37 GMT 2023`
Record UNII	KCP7WKG3TK
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

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

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

Systematic Name

English

Code System Code Type Description

FDA UNII

KCP7WKG3TK

Created by admin on Sat Dec 16 01:55:37 GMT 2023 , Edited by admin on Sat Dec 16 01:55:37 GMT 2023

PRIMARY

PUBCHEM

3078493

Created by admin on Sat Dec 16 01:55:37 GMT 2023 , Edited by admin on Sat Dec 16 01:55:37 GMT 2023

PRIMARY

CAS

121497-12-9

Created by admin on Sat Dec 16 01:55:37 GMT 2023 , Edited by admin on Sat Dec 16 01:55:37 GMT 2023

PRIMARY

EPA CompTox

DTXSID80153280

Created by admin on Sat Dec 16 01:55:37 GMT 2023 , Edited by admin on Sat Dec 16 01:55:37 GMT 2023

PRIMARY