[1-(dimethylamino)-1-[(E)-octadec-9-enoyl]oxy-propan-2-yl] (E)-octadec-9-enoate

Systemtic Name: [1-(dimethylamino)-1-[(E)-octadec-9-enoyl]oxy-propan-2-yl] (E)-octadec-9-enoate Openeye Name: [2-(dimethylamino)-1-methyl-2-[(E)-octadec-9-enoyl]oxy-ethyl] (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [1-(dimethylamino)-1-[(E)-1-oxooctadec-9-enoxy]propan-2-yl] ester IUPAC Name: [1-(dimethylamino)-1-[(E)-octadec-9-enoyl]oxypropan-2-yl] (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid [2-(dimethylamino)-1-methyl-2-[(E)-octadec-9-enoyl]oxy-ethyl] ester Formula: C41H77NO4 MolecularWeight: 648.05438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(C)C(N(C)C)OC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(C)C(N(C)C)OC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C41H77NO4/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39(43)45-38(3)41(42(4)5)46-40(44)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,38,41H,6-19,24-37H2,1-5H3/b22-20+,23-21+