[(E)-12-oxidanyloctadec-9-enyl]-tris(phenylmethyl)azanium

Systemtic Name: [(E)-12-oxidanyloctadec-9-enyl]-tris(phenylmethyl)azanium Openeye Name: tribenzyl-[(E)-12-hydroxyoctadec-9-enyl]ammonium CAS Name: [(E)-12-hydroxyoctadec-9-enyl]-tris(phenylmethyl)ammonium IUPAC Name: tribenzyl-[(E)-12-hydroxyoctadec-9-enyl]azanium Traditional Name: tribenzyl-[(E)-12-hydroxyoctadec-9-enyl]ammonium Formula: C39H56NO+ MolecularWeight: 554.86804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC[N+](CC1=CC=CC=C1)(CC2=CC=CC=C2)CC3=CC=CC=C3)O

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCCCC[N+](CC1=CC=CC=C1)(CC2=CC=CC=C2)CC3=CC=CC=C3)O

InChI

InChI=1S/C39H56NO/c1-2-3-4-21-30-39(41)31-22-10-8-6-5-7-9-11-23-32-40(33-36-24-15-12-16-25-36,34-37-26-17-13-18-27-37)35-38-28-19-14-20-29-38/h10,12-20,22,24-29,39,41H,2-9,11,21,23,30-35H2,1H3/q+1/b22-10+