chloromethyl-methyl-bis[3-[[(E)-octadec-9-enoyl]amino]propyl]azanium

Systemtic Name: chloromethyl-methyl-bis[3-[[(E)-octadec-9-enoyl]amino]propyl]azanium Openeye Name: chloromethyl-methyl-bis[3-[[(E)-octadec-9-enoyl]amino]propyl]ammonium CAS Name: chloromethyl-methyl-bis[3-[[(E)-1-oxooctadec-9-enyl]amino]propyl]ammonium IUPAC Name: chloromethyl-methyl-bis[3-[[(E)-octadec-9-enoyl]amino]propyl]azanium Traditional Name: chloromethyl-methyl-bis[3-[[(E)-octadec-9-enoyl]amino]propyl]ammonium Formula: C44H85ClN3O2+ MolecularWeight: 723.6176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NCCC[N+](C)(CCCNC(=O)CCCCCCCC=CCCCCCCCC)CCl

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NCCC[N+](CCl)(CCCNC(=O)CCCCCCC/C=C/CCCCCCCC)C

InChI

InChI=1S/C44H84ClN3O2/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-36-43(49)46-38-34-40-48(3,42-45)41-35-39-47-44(50)37-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h18-21H,4-17,22-42H2,1-3H3,(H-,46,47,49,50)/p+1/b20-18+,21-19+