(Z)-chloromethyl-methyl-[(E)-1-[(E)-octadec-9-enoyl]oxyhenicos-12-en-2-ylidene]azanium

Systemtic Name: (Z)-chloromethyl-methyl-[(E)-1-[(E)-octadec-9-enoyl]oxyhenicos-12-en-2-ylidene]azanium Openeye Name: (Z)-chloromethyl-methyl-[(E)-1-[[(E)-octadec-9-enoyl]oxymethyl]icos-11-enylidene]ammonium CAS Name: (Z)-chloromethyl-methyl-[(E)-1-[(E)-1-oxooctadec-9-enoxy]heneicos-12-en-2-ylidene]ammonium IUPAC Name: (Z)-chloromethyl-methyl-[(E)-1-[(E)-octadec-9-enoyl]oxyhenicos-12-en-2-ylidene]azanium Traditional Name: (Z)-chloromethyl-methyl-[(E)-1-[[(E)-octadec-9-enoyl]oxymethyl]eicos-11-enylidene]ammonium Formula: C41H77ClNO2+ MolecularWeight: 651.50858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCC(=[N+](C)CCl)COC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCC/C(=[N+](\C)/CCl)/COC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C41H77ClNO2/c1-4-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-36-40(43(3)39-42)38-45-41(44)37-35-33-31-29-27-25-22-19-17-15-13-11-9-7-5-2/h18-20,22H,4-17,21,23-39H2,1-3H3/q+1/b20-18+,22-19+,43-40-