4-[(3-cyano-7-methyl-quinolin-2-yl)amino]benzoic acid

Systemtic Name: 4-[(3-cyano-7-methyl-quinolin-2-yl)amino]benzoic acid Openeye Name: 4-[(3-cyano-7-methyl-2-quinolyl)amino]benzoic acid CAS Name: 4-[(3-cyano-7-methyl-2-quinolinyl)amino]benzoic acid IUPAC Name: 4-[(3-cyano-7-methylquinolin-2-yl)amino]benzoic acid Traditional Name: 4-[(3-cyano-7-methyl-2-quinolyl)amino]benzoic acid Formula: C18H13N3O2 MolecularWeight: 303.31472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)NC3=CC=C(C=C3)C(=O)O)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)NC3=CC=C(C=C3)C(=O)O)C#N

InChI

InChI=1S/C18H13N3O2/c1-11-2-3-13-9-14(10-19)17(21-16(13)8-11)20-15-6-4-12(5-7-15)18(22)23/h2-9H,1H3,(H,20,21)(H,22,23)