N-[[1-[2-(2-chlorophenyl)carbonyl-4-nitro-phenyl]-3,5-dimethyl-pyrrol-2-yl]methyl]benzamide

Systemtic Name: N-[[1-[2-(2-chlorophenyl)carbonyl-4-nitro-phenyl]-3,5-dimethyl-pyrrol-2-yl]methyl]benzamide Openeye Name: N-[[1-[2-(2-chlorobenzoyl)-4-nitro-phenyl]-3,5-dimethyl-pyrrol-2-yl]methyl]benzamide CAS Name: N-[[1-[2-[(2-chlorophenyl)-oxomethyl]-4-nitrophenyl]-3,5-dimethyl-2-pyrrolyl]methyl]benzamide IUPAC Name: N-[[1-[2-(2-chlorobenzoyl)-4-nitrophenyl]-3,5-dimethylpyrrol-2-yl]methyl]benzamide Traditional Name: N-[[1-[2-(2-chlorobenzoyl)-4-nitro-phenyl]-3,5-dimethyl-pyrrol-2-yl]methyl]benzamide Formula: C27H22ClN3O4 MolecularWeight: 487.93428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3Cl)CNC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3Cl)CNC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H22ClN3O4/c1-17-14-18(2)30(25(17)16-29-27(33)19-8-4-3-5-9-19)24-13-12-20(31(34)35)15-22(24)26(32)21-10-6-7-11-23(21)28/h3-15H,16H2,1-2H3,(H,29,33)