ethyl 6-chloranyl-4-[(3,4-dimethoxyphenyl)amino]-8-methyl-quinoline-3-carboxylate hydrochloride

Systemtic Name: ethyl 6-chloranyl-4-[(3,4-dimethoxyphenyl)amino]-8-methyl-quinoline-3-carboxylate hydrochloride Openeye Name: ethyl 6-chloro-4-(3,4-dimethoxyanilino)-8-methyl-quinoline-3-carboxylate hydrochloride CAS Name: 6-chloro-4-(3,4-dimethoxyanilino)-8-methyl-3-quinolinecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 6-chloro-4-(3,4-dimethoxyanilino)-8-methylquinoline-3-carboxylate hydrochloride Traditional Name: 6-chloro-4-(3,4-dimethoxyanilino)-8-methyl-quinoline-3-carboxylic acid ethyl ester hydrochloride Formula: C21H22Cl2N2O4 MolecularWeight: 437.31638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=CC(=C2N=C1)C)Cl)NC3=CC(=C(C=C3)OC)OC.Cl

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=CC(=C2N=C1)C)Cl)NC3=CC(=C(C=C3)OC)OC.Cl

InChI

InChI=1S/C21H21ClN2O4.ClH/c1-5-28-21(25)16-11-23-19-12(2)8-13(22)9-15(19)20(16)24-14-6-7-17(26-3)18(10-14)27-4;/h6-11H,5H2,1-4H3,(H,23,24);1H