4-methyl-3-[[4-[(3-methyl-4-nitro-phenyl)methyl]piperazin-1-yl]methyl]-2-(2-methylpropyl)benzamide

Systemtic Name: 4-methyl-3-[[4-[(3-methyl-4-nitro-phenyl)methyl]piperazin-1-yl]methyl]-2-(2-methylpropyl)benzamide Openeye Name: 2-isobutyl-4-methyl-3-[[4-[(3-methyl-4-nitro-phenyl)methyl]piperazin-1-yl]methyl]benzamide CAS Name: 4-methyl-3-[[4-[(3-methyl-4-nitrophenyl)methyl]-1-piperazinyl]methyl]-2-(2-methylpropyl)benzamide IUPAC Name: 4-methyl-3-[[4-[(3-methyl-4-nitrophenyl)methyl]piperazin-1-yl]methyl]-2-(2-methylpropyl)benzamide Traditional Name: 2-isobutyl-4-methyl-3-[[4-(3-methyl-4-nitro-benzyl)piperazino]methyl]benzamide Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)N)CC(C)C)CN2CCN(CC2)CC3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)N)CC(C)C)CN2CCN(CC2)CC3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C25H34N4O3/c1-17(2)13-22-21(25(26)30)7-5-18(3)23(22)16-28-11-9-27(10-12-28)15-20-6-8-24(29(31)32)19(4)14-20/h5-8,14,17H,9-13,15-16H2,1-4H3,(H2,26,30)