2-[(4-fluorophenyl)amino]-6-nitro-4-oxidanylidene-1H-quinazoline-8-carboxylic acid

Systemtic Name: 2-[(4-fluorophenyl)amino]-6-nitro-4-oxidanylidene-1H-quinazoline-8-carboxylic acid Openeye Name: 2-(4-fluoroanilino)-6-nitro-4-oxo-1H-quinazoline-8-carboxylic acid CAS Name: 2-(4-fluoroanilino)-6-nitro-4-oxo-1H-quinazoline-8-carboxylic acid IUPAC Name: 2-(4-fluoroanilino)-6-nitro-4-oxo-1H-quinazoline-8-carboxylic acid Traditional Name: 2-(4-fluoroanilino)-4-keto-6-nitro-1H-quinazoline-8-carboxylic acid Formula: C15H9FN4O5 MolecularWeight: 344.254163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC(=O)C3=CC(=CC(=C3N2)C(=O)O)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1NC2=NC(=O)C3=CC(=CC(=C3N2)C(=O)O)[N+](=O)[O-])F

InChI

InChI=1S/C15H9FN4O5/c16-7-1-3-8(4-2-7)17-15-18-12-10(13(21)19-15)5-9(20(24)25)6-11(12)14(22)23/h1-6H,(H,22,23)(H2,17,18,19,21)