N-[7-(4-chlorophenyl)-5-oxidanylidene-7,8-dihydro-6H-quinazolin-2-yl]-4-nitro-benzamide

Systemtic Name: N-[7-(4-chlorophenyl)-5-oxidanylidene-7,8-dihydro-6H-quinazolin-2-yl]-4-nitro-benzamide Openeye Name: N-[7-(4-chlorophenyl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]-4-nitro-benzamide CAS Name: N-[7-(4-chlorophenyl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]-4-nitrobenzamide IUPAC Name: N-[7-(4-chlorophenyl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]-4-nitrobenzamide Traditional Name: N-[7-(4-chlorophenyl)-5-keto-7,8-dihydro-6H-quinazolin-2-yl]-4-nitro-benzamide Formula: C21H15ClN4O4 MolecularWeight: 422.8212

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C2=CN=C(N=C21)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

Isomeric SMILES

C1C(CC(=O)C2=CN=C(N=C21)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN4O4/c22-15-5-1-12(2-6-15)14-9-18-17(19(27)10-14)11-23-21(24-18)25-20(28)13-3-7-16(8-4-13)26(29)30/h1-8,11,14H,9-10H2,(H,23,24,25,28)