dimethyl(propyl)azanium; (E)-N-[(E)-octadec-9-enoyl]octadec-9-enamide; chloride

Systemtic Name: dimethyl(propyl)azanium; (E)-N-[(E)-octadec-9-enoyl]octadec-9-enamide; chloride Openeye Name: dimethyl(propyl)ammonium; (E)-N-[(E)-octadec-9-enoyl]octadec-9-enamide; chloride CAS Name: dimethyl(propyl)ammonium; (E)-N-[(E)-1-oxooctadec-9-enyl]-9-octadecenamide; chloride IUPAC Name: dimethyl(propyl)azanium; (E)-N-[(E)-octadec-9-enoyl]octadec-9-enamide; chloride Traditional Name: dimethyl(propyl)ammonium; (E)-N-[(E)-octadec-9-enoyl]octadec-9-enamide; chloride Formula: C41H81ClN2O2 MolecularWeight: 669.54704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC(=O)CCCCCCCC=CCCCCCCCC.CCC[NH+](C)C.[Cl-]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC(=O)CCCCCCC/C=C/CCCCCCCC.CCC[NH+](C)C.[Cl-]

InChI

InChI=1S/C36H67NO2.C5H13N.ClH/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(38)37-36(39)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-4-5-6(2)3;/h17-20H,3-16,21-34H2,1-2H3,(H,37,38,39);4-5H2,1-3H3;1H/b19-17+,20-18+;;