4-(methylamino)-N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-3-nitro-benzamide

Systemtic Name: 4-(methylamino)-N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-3-nitro-benzamide Openeye Name: 4-(methylamino)-N-[[2-[(2-methyl-1-piperidyl)methyl]phenyl]methyl]-3-nitro-benzamide CAS Name: 4-(methylamino)-N-[[2-[(2-methyl-1-piperidinyl)methyl]phenyl]methyl]-3-nitrobenzamide IUPAC Name: 4-(methylamino)-N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-3-nitrobenzamide Traditional Name: 4-(methylamino)-N-[2-[(2-methylpiperidino)methyl]benzyl]-3-nitro-benzamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC2=CC=CC=C2CNC(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1CC2=CC=CC=C2CNC(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O3/c1-16-7-5-6-12-25(16)15-19-9-4-3-8-18(19)14-24-22(27)17-10-11-20(23-2)21(13-17)26(28)29/h3-4,8-11,13,16,23H,5-7,12,14-15H2,1-2H3,(H,24,27)