diethyl-bis[(E)-octadec-9-enoyl]azanium chloride

Systemtic Name: diethyl-bis[(E)-octadec-9-enoyl]azanium chloride Openeye Name: diethyl-bis[(E)-octadec-9-enoyl]ammonium chloride CAS Name: diethyl-bis[(E)-1-oxooctadec-9-enyl]ammonium chloride IUPAC Name: diethyl-bis[(E)-octadec-9-enoyl]azanium chloride Traditional Name: diethyl-bis[(E)-octadec-9-enoyl]ammonium chloride Formula: C40H76ClNO2 MolecularWeight: 638.48994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)[N+](CC)(CC)C(=O)CCCCCCCC=CCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)[N+](C(=O)CCCCCCC/C=C/CCCCCCCC)(CC)CC.[Cl-]

InChI

InChI=1S/C40H76NO2.ClH/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(42)41(7-3,8-4)40(43)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-6-2;/h21-24H,5-20,25-38H2,1-4H3;1H/q+1;/p-1/b23-21+,24-22+;