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3-[[[3-[dimethyl-(phenylmethyl)azaniumyl]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl-dimethyl-(phenylmethyl)azanium

3-[[[3-[dimethyl-(phenylmethyl)azaniumyl]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl-dimethyl-(phenylmethyl)azanium

Systemtic Name:3-[[[3-[dimethyl-(phenylmethyl)azaniumyl]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl-dimethyl-(phenylmethyl)azanium
Openeye Name:benzyl-[3-[[[3-[benzyl(dimethyl)ammonio]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl]-dimethyl-ammonium
CAS Name:3-[[[3-[dimethyl-(phenylmethyl)ammonio]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl-dimethyl-(phenylmethyl)ammonium
IUPAC Name:benzyl-[3-[[[3-[benzyl(dimethyl)azaniumyl]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl]-dimethylazanium
Traditional Name:benzyl-[3-[[[3-[benzyl(dimethyl)ammonio]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl]-dimethyl-ammonium
Formula: C31H47N4O2P+2
MolecularWeight: 538.704241
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OP(=O)(NCCC[N+](C)(C)CC2=CC=CC=C2)NCCC[N+](C)(C)CC3=CC=CC=C3


Isomeric SMILES

CC1=CC=C(C=C1)OP(=O)(NCCC[N+](C)(C)CC2=CC=CC=C2)NCCC[N+](C)(C)CC3=CC=CC=C3


InChI

InChI=1S/C31H47N4O2P/c1-28-18-20-31(21-19-28)37-38(36,32-22-12-24-34(2,3)26-29-14-8-6-9-15-29)33-23-13-25-35(4,5)27-30-16-10-7-11-17-30/h6-11,14-21H,12-13,22-27H2,1-5H3,(H2,32,33,36)/q+2


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