2-(4-nitrophenyl)-4-oxidanylidene-1H-quinazoline-5-carboxylic acid

Systemtic Name: 2-(4-nitrophenyl)-4-oxidanylidene-1H-quinazoline-5-carboxylic acid Openeye Name: 2-(4-nitrophenyl)-4-oxo-1H-quinazoline-5-carboxylic acid CAS Name: 2-(4-nitrophenyl)-4-oxo-1H-quinazoline-5-carboxylic acid IUPAC Name: 2-(4-nitrophenyl)-4-oxo-1H-quinazoline-5-carboxylic acid Traditional Name: 4-keto-2-(4-nitrophenyl)-1H-quinazoline-5-carboxylic acid Formula: C15H9N3O5 MolecularWeight: 311.24906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)NC(=NC2=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=C2C(=C1)NC(=NC2=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H9N3O5/c19-14-12-10(15(20)21)2-1-3-11(12)16-13(17-14)8-4-6-9(7-5-8)18(22)23/h1-7H,(H,20,21)(H,16,17,19)