4-[(6-nitro-4-oxidanylidene-quinazolin-3-yl)methyl]-N-phenyl-benzamide

Systemtic Name: 4-[(6-nitro-4-oxidanylidene-quinazolin-3-yl)methyl]-N-phenyl-benzamide Openeye Name: 4-[(6-nitro-4-oxo-quinazolin-3-yl)methyl]-N-phenyl-benzamide CAS Name: 4-[(6-nitro-4-oxo-3-quinazolinyl)methyl]-N-phenylbenzamide IUPAC Name: 4-[(6-nitro-4-oxoquinazolin-3-yl)methyl]-N-phenylbenzamide Traditional Name: 4-[(4-keto-6-nitro-quinazolin-3-yl)methyl]-N-phenyl-benzamide Formula: C22H16N4O4 MolecularWeight: 400.38684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O4/c27-21(24-17-4-2-1-3-5-17)16-8-6-15(7-9-16)13-25-14-23-20-11-10-18(26(29)30)12-19(20)22(25)28/h1-12,14H,13H2,(H,24,27)