N-[2-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-3-yl]-3-nitro-benzamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-3-yl]-3-nitro-benzamide Openeye Name: N-[2-(3,4-dimethylphenyl)-4-oxo-quinazolin-3-yl]-3-nitro-benzamide CAS Name: N-[2-(3,4-dimethylphenyl)-4-oxo-3-quinazolinyl]-3-nitrobenzamide IUPAC Name: N-[2-(3,4-dimethylphenyl)-4-oxoquinazolin-3-yl]-3-nitrobenzamide Traditional Name: N-[2-(3,4-dimethylphenyl)-4-keto-quinazolin-3-yl]-3-nitro-benzamide Formula: C23H18N4O4 MolecularWeight: 414.41342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C23H18N4O4/c1-14-10-11-16(12-15(14)2)21-24-20-9-4-3-8-19(20)23(29)26(21)25-22(28)17-6-5-7-18(13-17)27(30)31/h3-13H,1-2H3,(H,25,28)