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

Systemtic Name: N-(4-fluorophenyl)-2-[(4-fluorophenyl)amino]-6-nitro-4-oxidanylidene-1H-quinazoline-8-carboxamide Openeye Name: 2-(4-fluoroanilino)-N-(4-fluorophenyl)-6-nitro-4-oxo-1H-quinazoline-8-carboxamide CAS Name: 2-(4-fluoroanilino)-N-(4-fluorophenyl)-6-nitro-4-oxo-1H-quinazoline-8-carboxamide IUPAC Name: 2-(4-fluoroanilino)-N-(4-fluorophenyl)-6-nitro-4-oxo-1H-quinazoline-8-carboxamide Traditional Name: 2-(4-fluoroanilino)-N-(4-fluorophenyl)-4-keto-6-nitro-1H-quinazoline-8-carboxamide Formula: C21H13F2N5O4 MolecularWeight: 437.355826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC(=O)C3=CC(=CC(=C3N2)C(=O)NC4=CC=C(C=C4)F)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1NC2=NC(=O)C3=CC(=CC(=C3N2)C(=O)NC4=CC=C(C=C4)F)[N+](=O)[O-])F

InChI

InChI=1S/C21H13F2N5O4/c22-11-1-5-13(6-2-11)24-19(29)16-9-15(28(31)32)10-17-18(16)26-21(27-20(17)30)25-14-7-3-12(23)4-8-14/h1-10H,(H,24,29)(H2,25,26,27,30)