4-[(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoic acid

Systemtic Name: 4-[(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoic acid Openeye Name: 4-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoic acid CAS Name: 4-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoic acid IUPAC Name: 4-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoic acid Traditional Name: 4-[(4-keto-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoic acid Formula: C15H15N3O3 MolecularWeight: 285.2979

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N=C(N2)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CCC2=C(C1)C(=O)N=C(N2)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C15H15N3O3/c19-13-11-3-1-2-4-12(11)17-15(18-13)16-10-7-5-9(6-8-10)14(20)21/h5-8H,1-4H2,(H,20,21)(H2,16,17,18,19)