3-(6-azanyl-4-oxidanylidene-quinazolin-3-yl)benzoic acid

Systemtic Name: 3-(6-azanyl-4-oxidanylidene-quinazolin-3-yl)benzoic acid Openeye Name: 3-(6-amino-4-oxo-quinazolin-3-yl)benzoic acid CAS Name: 3-(6-amino-4-oxo-3-quinazolinyl)benzoic acid IUPAC Name: 3-(6-amino-4-oxoquinazolin-3-yl)benzoic acid Traditional Name: 3-(6-amino-4-keto-quinazolin-3-yl)benzoic acid Formula: C15H11N3O3 MolecularWeight: 281.26614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C=NC3=C(C2=O)C=C(C=C3)N)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N2C=NC3=C(C2=O)C=C(C=C3)N)C(=O)O

InChI

InChI=1S/C15H11N3O3/c16-10-4-5-13-12(7-10)14(19)18(8-17-13)11-3-1-2-9(6-11)15(20)21/h1-8H,16H2,(H,20,21)