1,3-bis[(E)-heptadec-8-enoxy]propan-2-ylidene-(chloromethyl)-methyl-azanium

Systemtic Name: 1,3-bis[(E)-heptadec-8-enoxy]propan-2-ylidene-(chloromethyl)-methyl-azanium Openeye Name: chloromethyl-[2-[(E)-heptadec-8-enoxy]-1-[[(E)-heptadec-8-enoxy]methyl]ethylidene]-methyl-ammonium CAS Name: 1,3-bis[(E)-heptadec-8-enoxy]propan-2-ylidene-(chloromethyl)-methylammonium IUPAC Name: 1,3-bis[(E)-heptadec-8-enoxy]propan-2-ylidene-(chloromethyl)-methylazanium Traditional Name: chloromethyl-[2-[(E)-heptadec-8-enoxy]-1-[[(E)-heptadec-8-enoxy]methyl]ethylidene]-methyl-ammonium Formula: C39H75ClNO2+ MolecularWeight: 625.4713

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCOCC(=[N+](C)CCl)COCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCOCC(=[N+](CCl)C)COCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C39H75ClNO2/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-42-36-39(41(3)38-40)37-43-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h18-21H,4-17,22-38H2,1-3H3/q+1/b20-18+,21-19+