N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[4-[4-(m-tolyl)piperazin-1-yl]butyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[4-[4-(3-methylphenyl)-1-piperazinyl]butyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[4-[4-(m-tolyl)piperazino]butyl]-1-(2-nitrophenyl)isonipecotamide Formula: C27H37N5O3 MolecularWeight: 479.61438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCCNC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C27H37N5O3/c1-22-7-6-8-24(21-22)30-19-17-29(18-20-30)14-5-4-13-28-27(33)23-11-15-31(16-12-23)25-9-2-3-10-26(25)32(34)35/h2-3,6-10,21,23H,4-5,11-20H2,1H3,(H,28,33)