4-[(3-methylcinnolin-4-yl)amino]benzoic acid

Systemtic Name: 4-[(3-methylcinnolin-4-yl)amino]benzoic acid Openeye Name: 4-[(3-methylcinnolin-4-yl)amino]benzoic acid CAS Name: 4-[(3-methyl-4-cinnolinyl)amino]benzoic acid IUPAC Name: 4-[(3-methylcinnolin-4-yl)amino]benzoic acid Traditional Name: 4-[(3-methylcinnolin-4-yl)amino]benzoic acid Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=N1)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=N1)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H13N3O2/c1-10-15(13-4-2-3-5-14(13)19-18-10)17-12-8-6-11(7-9-12)16(20)21/h2-9H,1H3,(H,17,19)(H,20,21)