2-[dimethyl-[(E)-octadec-9-enyl]azaniumyl]ethyl-dimethyl-[(E)-octadec-9-enyl]azanium

Systemtic Name: 2-[dimethyl-[(E)-octadec-9-enyl]azaniumyl]ethyl-dimethyl-[(E)-octadec-9-enyl]azanium Openeye Name: 2-[dimethyl-[(E)-octadec-9-enyl]ammonio]ethyl-dimethyl-[(E)-octadec-9-enyl]ammonium CAS Name: 2-[dimethyl-[(E)-octadec-9-enyl]ammonio]ethyl-dimethyl-[(E)-octadec-9-enyl]ammonium IUPAC Name: 2-[dimethyl-[(E)-octadec-9-enyl]azaniumyl]ethyl-dimethyl-[(E)-octadec-9-enyl]azanium Traditional Name: 2-[dimethyl-[(E)-octadec-9-enyl]ammonio]ethyl-dimethyl-[(E)-octadec-9-enyl]ammonium Formula: C42H86N2+2 MolecularWeight: 619.14564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC[N+](C)(C)CC[N+](C)(C)CCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC[N+](CC[N+](CCCCCCCC/C=C/CCCCCCCC)(C)C)(C)C

InChI

InChI=1S/C42H86N2/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-43(3,4)41-42-44(5,6)40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h21-24H,7-20,25-42H2,1-6H3/q+2/b23-21+,24-22+