6-[(3-cyano-6,7-dimethoxy-quinolin-4-yl)amino]-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 6-[(3-cyano-6,7-dimethoxy-quinolin-4-yl)amino]-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 6-[(3-cyano-6,7-dimethoxy-4-quinolyl)amino]-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 6-[(3-cyano-6,7-dimethoxy-4-quinolinyl)amino]-6-methyl-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 6-[(3-cyano-6,7-dimethoxyquinolin-4-yl)amino]-6-methylcyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 6-[(3-cyano-6,7-dimethoxy-4-quinolyl)amino]-6-methyl-cyclohexa-2,4-diene-1-carboxylic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC=CC1C(=O)O)NC2=C(C=NC3=CC(=C(C=C32)OC)OC)C#N

Isomeric SMILES

CC1(C=CC=CC1C(=O)O)NC2=C(C=NC3=CC(=C(C=C32)OC)OC)C#N

InChI

InChI=1S/C20H19N3O4/c1-20(7-5-4-6-14(20)19(24)25)23-18-12(10-21)11-22-15-9-17(27-3)16(26-2)8-13(15)18/h4-9,11,14H,1-3H3,(H,22,23)(H,24,25)