dimethyl-[(E)-octadec-9-enoyl]-[2-[(E)-octadec-9-enoyl]oxy-2-oxidanylidene-ethyl]azanium

Systemtic Name: dimethyl-[(E)-octadec-9-enoyl]-[2-[(E)-octadec-9-enoyl]oxy-2-oxidanylidene-ethyl]azanium Openeye Name: dimethyl-[(E)-octadec-9-enoyl]-[2-[(E)-octadec-9-enoyl]oxy-2-oxo-ethyl]ammonium CAS Name: dimethyl-[(E)-1-oxooctadec-9-enyl]-[2-oxo-2-[(E)-1-oxooctadec-9-enoxy]ethyl]ammonium IUPAC Name: dimethyl-[(E)-octadec-9-enoyl]-[2-[(E)-octadec-9-enoyl]oxy-2-oxoethyl]azanium Traditional Name: [2-keto-2-[(E)-octadec-9-enoyl]oxy-ethyl]-dimethyl-[(E)-octadec-9-enoyl]ammonium Formula: C40H74NO4+ MolecularWeight: 633.01986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)[N+](C)(C)CC(=O)OC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)[N+](C)(C)CC(=O)OC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C40H74NO4/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38(42)41(3,4)37-40(44)45-39(43)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h19-22H,5-18,23-37H2,1-4H3/q+1/b21-19+,22-20+