bis[2-[(E)-heptadec-8-enoxy]ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: bis[2-[(E)-heptadec-8-enoxy]ethyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-bis[2-[(E)-heptadec-8-enoxy]ethyl]-methyl-ammonium CAS Name: bis[2-[(E)-heptadec-8-enoxy]ethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-bis[2-[(E)-heptadec-8-enoxy]ethyl]-methylazanium Traditional Name: benzyl-bis[2-[(E)-heptadec-8-enoxy]ethyl]-methyl-ammonium Formula: C46H84NO2+ MolecularWeight: 683.16466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCOCC[N+](C)(CCOCCCCCCCC=CCCCCCCCC)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCOCC[N+](CC1=CC=CC=C1)(CCOCCCCCCC/C=C/CCCCCCCC)C

InChI

InChI=1S/C46H84NO2/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-35-41-48-43-39-47(3,45-46-37-33-32-34-38-46)40-44-49-42-36-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h18-21,32-34,37-38H,4-17,22-31,35-36,39-45H2,1-3H3/q+1/b20-18+,21-19+