3-[(6-methylquinazolin-4-yl)amino]benzoic acid hydrochloride

Systemtic Name: 3-[(6-methylquinazolin-4-yl)amino]benzoic acid hydrochloride Openeye Name: 3-[(6-methylquinazolin-4-yl)amino]benzoic acid hydrochloride CAS Name: 3-[(6-methyl-4-quinazolinyl)amino]benzoic acid hydrochloride IUPAC Name: 3-[(6-methylquinazolin-4-yl)amino]benzoic acid hydrochloride Traditional Name: 3-[(6-methylquinazolin-4-yl)amino]benzoic acid hydrochloride Formula: C16H14ClN3O2 MolecularWeight: 315.75426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=CN=C2NC3=CC=CC(=C3)C(=O)O.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=CN=C2NC3=CC=CC(=C3)C(=O)O.Cl

InChI

InChI=1S/C16H13N3O2.ClH/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);1H