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

Systemtic Name: 3-[[[3-[diethyl-(phenylmethyl)azaniumyl]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl-diethyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[[3-[benzyl(diethyl)ammonio]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl]-diethyl-ammonium CAS Name: 3-[[[3-[diethyl-(phenylmethyl)ammonio]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl-diethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[[3-[benzyl(diethyl)azaniumyl]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl]-diethylazanium Traditional Name: benzyl-[3-[[[3-[benzyl(diethyl)ammonio]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl]-diethyl-ammonium Formula: C35H55N4O2P+2 MolecularWeight: 594.810561

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CCCNP(=O)(NCCC[N+](CC)(CC)CC1=CC=CC=C1)OC2=CC=C(C=C2)C)CC3=CC=CC=C3

Isomeric SMILES

CC[N+](CC)(CCCNP(=O)(NCCC[N+](CC)(CC)CC1=CC=CC=C1)OC2=CC=C(C=C2)C)CC3=CC=CC=C3

InChI

InChI=1S/C35H55N4O2P/c1-6-38(7-2,30-33-18-12-10-13-19-33)28-16-26-36-42(40,41-35-24-22-32(5)23-25-35)37-27-17-29-39(8-3,9-4)31-34-20-14-11-15-21-34/h10-15,18-25H,6-9,16-17,26-31H2,1-5H3,(H2,36,37,40)/q+2