N-[[1-[2-(2-chlorophenyl)carbonyl-4-nitro-phenyl]-3-methyl-pyrrol-2-yl]methyl]ethanamide

Systemtic Name: N-[[1-[2-(2-chlorophenyl)carbonyl-4-nitro-phenyl]-3-methyl-pyrrol-2-yl]methyl]ethanamide Openeye Name: N-[[1-[2-(2-chlorobenzoyl)-4-nitro-phenyl]-3-methyl-pyrrol-2-yl]methyl]acetamide CAS Name: N-[[1-[2-[(2-chlorophenyl)-oxomethyl]-4-nitrophenyl]-3-methyl-2-pyrrolyl]methyl]acetamide IUPAC Name: N-[[1-[2-(2-chlorobenzoyl)-4-nitrophenyl]-3-methylpyrrol-2-yl]methyl]acetamide Traditional Name: N-[[1-[2-(2-chlorobenzoyl)-4-nitro-phenyl]-3-methyl-pyrrol-2-yl]methyl]acetamide Formula: C21H18ClN3O4 MolecularWeight: 411.83832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C=C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3Cl)CNC(=O)C

Isomeric SMILES

CC1=C(N(C=C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3Cl)CNC(=O)C

InChI

InChI=1S/C21H18ClN3O4/c1-13-9-10-24(20(13)12-23-14(2)26)19-8-7-15(25(28)29)11-17(19)21(27)16-5-3-4-6-18(16)22/h3-11H,12H2,1-2H3,(H,23,26)