3-[3-hexadecoxypropoxy-(phenylmethyl)peroxy-phosphoryl]oxypropyl-trimethyl-azanium

Systemtic Name: 3-[3-hexadecoxypropoxy-(phenylmethyl)peroxy-phosphoryl]oxypropyl-trimethyl-azanium Openeye Name: 3-[benzylperoxy(3-hexadecoxypropoxy)phosphoryl]oxypropyl-trimethyl-ammonium CAS Name: 3-[3-hexadecoxypropoxy-(phenylmethyl)dioxyphosphoryl]oxypropyl-trimethylammonium IUPAC Name: 3-[benzylperoxy(3-hexadecoxypropoxy)phosphoryl]oxypropyl-trimethylazanium Traditional Name: 3-[benzylperoxy(3-cetyloxypropoxy)phosphoryl]oxypropyl-trimethyl-ammonium Formula: C32H61NO6P+ MolecularWeight: 586.803601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCCOP(=O)(OCCC[N+](C)(C)C)OOCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCCOP(=O)(OCCC[N+](C)(C)C)OOCC1=CC=CC=C1

InChI

InChI=1S/C32H61NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-27-35-28-23-30-38-40(34,37-29-22-26-33(2,3)4)39-36-31-32-24-19-18-20-25-32/h18-20,24-25H,5-17,21-23,26-31H2,1-4H3/q+1