dimethyl-bis[2-[[(Z)-octadec-9-enoyl]amino]ethyl]azanium chloride

Systemtic Name: dimethyl-bis[2-[[(Z)-octadec-9-enoyl]amino]ethyl]azanium chloride Openeye Name: dimethyl-bis[2-[[(Z)-octadec-9-enoyl]amino]ethyl]ammonium chloride CAS Name: dimethyl-bis[2-[[(Z)-1-oxooctadec-9-enyl]amino]ethyl]ammonium chloride IUPAC Name: dimethyl-bis[2-[[(Z)-octadec-9-enoyl]amino]ethyl]azanium chloride Traditional Name: dimethyl-bis[2-[[(Z)-octadec-9-enoyl]amino]ethyl]ammonium chloride Formula: C42H82ClN3O2 MolecularWeight: 696.57238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)NCC[N+](CCNC(=O)CCCCCCC/C=C\CCCCCCCC)(C)C.[Cl-]

InChI

InChI=1S/C42H81N3O2.ClH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-41(46)43-37-39-45(3,4)40-38-44-42(47)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h19-22H,5-18,23-40H2,1-4H3,(H-,43,44,46,47);1H/b21-19-,22-20-;