3-[(6-methylquinazolin-4-yl)amino]benzoate

Systemtic Name: 3-[(6-methylquinazolin-4-yl)amino]benzoate Openeye Name: 3-[(6-methylquinazolin-4-yl)amino]benzoate CAS Name: 3-[(6-methyl-4-quinazolinyl)amino]benzoate IUPAC Name: 3-[(6-methylquinazolin-4-yl)amino]benzoate Traditional Name: 3-[(6-methylquinazolin-4-yl)amino]benzoate Formula: C16H12N3O2- MolecularWeight: 278.28538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=CN=C2NC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=CN=C2NC3=CC=CC(=C3)C(=O)[O-]

InChI

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