diethyl-[[4-[[[1-(2-nitrophenyl)piperidin-4-yl]carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[4-[[[1-(2-nitrophenyl)piperidin-4-yl]carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[4-[[[1-(2-nitrophenyl)piperidine-4-carbonyl]amino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[4-[[[[1-(2-nitrophenyl)-4-piperidinyl]-oxomethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[4-[[[1-(2-nitrophenyl)piperidine-4-carbonyl]amino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[4-[[[1-(2-nitrophenyl)isonipecotoyl]amino]methyl]benzyl]ammonium Formula: C24H33N4O3+ MolecularWeight: 425.54382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N4O3/c1-3-26(4-2)18-20-11-9-19(10-12-20)17-25-24(29)21-13-15-27(16-14-21)22-7-5-6-8-23(22)28(30)31/h5-12,21H,3-4,13-18H2,1-2H3,(H,25,29)/p+1