2-[(3,4-dichlorophenyl)amino]-6-nitro-4-oxidanylidene-1H-quinazoline-8-carboxylic acid

Systemtic Name: 2-[(3,4-dichlorophenyl)amino]-6-nitro-4-oxidanylidene-1H-quinazoline-8-carboxylic acid Openeye Name: 2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazoline-8-carboxylic acid CAS Name: 2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazoline-8-carboxylic acid IUPAC Name: 2-(3,4-dichloroanilino)-6-nitro-4-oxo-1H-quinazoline-8-carboxylic acid Traditional Name: 2-(3,4-dichloroanilino)-4-keto-6-nitro-1H-quinazoline-8-carboxylic acid Formula: C15H8Cl2N4O5 MolecularWeight: 395.15382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H8Cl2N4O5/c16-10-2-1-6(3-11(10)17)18-15-19-12-8(13(22)20-15)4-7(21(25)26)5-9(12)14(23)24/h1-5H,(H,23,24)(H2,18,19,20,22)