4-methyl-N-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-N-(phenylmethyl)benzamide

Systemtic Name: 4-methyl-N-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-methyl-3-nitro-N-[[1-(p-tolylmethyl)pyrrol-2-yl]methyl]benzamide CAS Name: 4-methyl-N-[[1-[(4-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-methyl-N-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-nitrobenzamide Traditional Name: N-benzyl-4-methyl-N-[[1-(4-methylbenzyl)pyrrol-2-yl]methyl]-3-nitro-benzamide Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=CC=C2CN(CC3=CC=CC=C3)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=CC=C2CN(CC3=CC=CC=C3)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C28H27N3O3/c1-21-10-13-24(14-11-21)18-29-16-6-9-26(29)20-30(19-23-7-4-3-5-8-23)28(32)25-15-12-22(2)27(17-25)31(33)34/h3-17H,18-20H2,1-2H3