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

Systemtic Name: N-[1-[7-chloranyl-3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-4-nitro-N-phenethyl-benzamide Openeye Name: N-[1-[7-chloro-4-oxo-3-(p-tolyl)quinazolin-2-yl]ethyl]-4-nitro-N-phenethyl-benzamide CAS Name: N-[1-[7-chloro-3-(4-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-4-nitro-N-phenethylbenzamide IUPAC Name: N-[1-[7-chloro-3-(4-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-4-nitro-N-phenethylbenzamide Traditional Name: N-[1-[7-chloro-4-keto-3-(p-tolyl)quinazolin-2-yl]ethyl]-4-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=C(C=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=C(C=C5)[N+](=O)[O-]

InChI

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