diethyl-[[4-[[[1-(2-methylphenyl)carbonylpiperidin-4-yl]carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[4-[[[1-(2-methylphenyl)carbonylpiperidin-4-yl]carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[4-[[[1-(2-methylbenzoyl)piperidine-4-carbonyl]amino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[4-[[[[1-[(2-methylphenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[4-[[[1-(2-methylbenzoyl)piperidine-4-carbonyl]amino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[4-[[(1-o-toluoylisonipecotoyl)amino]methyl]benzyl]ammonium Formula: C26H36N3O2+ MolecularWeight: 422.58294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C(=O)C3=CC=CC=C3C

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C(=O)C3=CC=CC=C3C

InChI

InChI=1S/C26H35N3O2/c1-4-28(5-2)19-22-12-10-21(11-13-22)18-27-25(30)23-14-16-29(17-15-23)26(31)24-9-7-6-8-20(24)3/h6-13,23H,4-5,14-19H2,1-3H3,(H,27,30)/p+1