[(E)-1-oxidanyl-2-(tetradecanoylamino)octadec-4-en-3-yl] dodecanoate

Systemtic Name: [(E)-1-oxidanyl-2-(tetradecanoylamino)octadec-4-en-3-yl] dodecanoate Openeye Name: [(E)-1-[2-hydroxy-1-(tetradecanoylamino)ethyl]hexadec-2-enyl] dodecanoate CAS Name: dodecanoic acid [(E)-1-hydroxy-2-(1-oxotetradecylamino)octadec-4-en-3-yl] ester IUPAC Name: [(E)-1-hydroxy-2-(tetradecanoylamino)octadec-4-en-3-yl] dodecanoate Traditional Name: lauric acid [(E)-1-[2-hydroxy-1-(tetradecanoylamino)ethyl]hexadec-2-enyl] ester Formula: C44H85NO4 MolecularWeight: 692.15

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(CO)NC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC/C=C/C(C(CO)NC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCCCC

InChI

InChI=1S/C44H85NO4/c1-4-7-10-13-16-19-21-22-24-26-28-31-34-37-42(49-44(48)39-36-33-30-25-18-15-12-9-6-3)41(40-46)45-43(47)38-35-32-29-27-23-20-17-14-11-8-5-2/h34,37,41-42,46H,4-33,35-36,38-40H2,1-3H3,(H,45,47)/b37-34+