N-[1-[7-chloranyl-3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-nitro-N-phenethyl-benzamide

Systemtic Name: N-[1-[7-chloranyl-3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-nitro-N-phenethyl-benzamide Openeye Name: N-[1-[7-chloro-4-oxo-3-(p-tolyl)quinazolin-2-yl]ethyl]-3-nitro-N-phenethyl-benzamide CAS Name: N-[1-[7-chloro-3-(4-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-3-nitro-N-phenethylbenzamide IUPAC Name: N-[1-[7-chloro-3-(4-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-3-nitro-N-phenethylbenzamide Traditional Name: N-[1-[7-chloro-4-keto-3-(p-tolyl)quinazolin-2-yl]ethyl]-3-nitro-N-phenethyl-benzamide Formula: C32H27ClN4O4 MolecularWeight: 567.03418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2C(C)N(CCC4=CC=CC=C4)C(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2C(C)N(CCC4=CC=CC=C4)C(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C32H27ClN4O4/c1-21-11-14-26(15-12-21)36-30(34-29-20-25(33)13-16-28(29)32(36)39)22(2)35(18-17-23-7-4-3-5-8-23)31(38)24-9-6-10-27(19-24)37(40)41/h3-16,19-20,22H,17-18H2,1-2H3