ethyl 6-chloranyl-4-[(3-ethoxycarbonylphenyl)amino]-8-methyl-quinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-4-[(3-ethoxycarbonylphenyl)amino]-8-methyl-quinoline-3-carboxylate Openeye Name: ethyl 6-chloro-4-(3-ethoxycarbonylanilino)-8-methyl-quinoline-3-carboxylate CAS Name: 6-chloro-4-(3-ethoxycarbonylanilino)-8-methyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-4-(3-ethoxycarbonylanilino)-8-methylquinoline-3-carboxylate Traditional Name: 4-(3-carbethoxyanilino)-6-chloro-8-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C22H21ClN2O4 MolecularWeight: 412.86614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC2=C(C=NC3=C(C=C(C=C32)Cl)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC2=C(C=NC3=C(C=C(C=C32)Cl)C)C(=O)OCC

InChI

InChI=1S/C22H21ClN2O4/c1-4-28-21(26)14-7-6-8-16(10-14)25-20-17-11-15(23)9-13(3)19(17)24-12-18(20)22(27)29-5-2/h6-12H,4-5H2,1-3H3,(H,24,25)