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

Systemtic Name: N-(3-methoxypropyl)-4-methyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-benzamide Openeye Name: N-(3-methoxypropyl)-4-methyl-3-nitro-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]benzamide CAS Name: N-(3-methoxypropyl)-4-methyl-N-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-nitrobenzamide IUPAC Name: N-(3-methoxypropyl)-4-methyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-nitrobenzamide Traditional Name: N-(3-methoxypropyl)-4-methyl-N-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-3-nitro-benzamide Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CCCOC)CC2=CC=CN2CC3=CC=CC=C3C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CCCOC)CC2=CC=CN2CC3=CC=CC=C3C)[N+](=O)[O-]

InChI

InChI=1S/C25H29N3O4/c1-19-8-4-5-9-22(19)17-26-13-6-10-23(26)18-27(14-7-15-32-3)25(29)21-12-11-20(2)24(16-21)28(30)31/h4-6,8-13,16H,7,14-15,17-18H2,1-3H3