2-(6-azanyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)benzoic acid

Systemtic Name: 2-(6-azanyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)benzoic acid Openeye Name: 2-(6-amino-4-oxo-4aH-quinazolin-3-ium-3-yl)benzoic acid CAS Name: 2-(6-amino-4-oxo-4aH-quinazolin-3-ium-3-yl)benzoic acid IUPAC Name: 2-(6-amino-4-oxo-4aH-quinazolin-3-ium-3-yl)benzoic acid Traditional Name: 2-(6-amino-4-keto-4aH-quinazolin-3-ium-3-yl)benzoic acid Formula: C15H12N3O3+ MolecularWeight: 282.27408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)[N+]2=CN=C3C=CC(=CC3C2=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)[N+]2=CN=C3C=CC(=CC3C2=O)N

InChI

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