[1-(2-ethanoyltetradecanoylamino)cyclohex-3-en-1-yl] (9E,12E)-octadeca-9,12-dienoate

Systemtic Name: [1-(2-ethanoyltetradecanoylamino)cyclohex-3-en-1-yl] (9E,12E)-octadeca-9,12-dienoate Openeye Name: [1-(2-acetyltetradecanoylamino)cyclohex-3-en-1-yl] (9E,12E)-octadeca-9,12-dienoate CAS Name: (9E,12E)-octadeca-9,12-dienoic acid [1-[(2-acetyl-1-oxotetradecyl)amino]-1-cyclohex-3-enyl] ester IUPAC Name: [1-(2-acetyltetradecanoylamino)cyclohex-3-en-1-yl] (9E,12E)-octadeca-9,12-dienoate Traditional Name: (9E,12E)-octadeca-9,12-dienoic acid [1-(2-acetyltetradecanoylamino)cyclohex-3-en-1-yl] ester Formula: C40H69NO4 MolecularWeight: 627.98016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(=O)C)C(=O)NC1(CCC=CC1)OC(=O)CCCCCCCC=CCC=CCCCCC

Isomeric SMILES

CCCCCCCCCCCCC(C(=O)C)C(=O)NC1(CCC=CC1)OC(=O)CCCCCCC/C=C/C/C=C/CCCCC

InChI

InChI=1S/C40H69NO4/c1-4-6-8-10-12-14-16-17-18-19-20-22-24-26-29-33-38(43)45-40(34-30-27-31-35-40)41-39(44)37(36(3)42)32-28-25-23-21-15-13-11-9-7-5-2/h12,14,17-18,27,30,37H,4-11,13,15-16,19-26,28-29,31-35H2,1-3H3,(H,41,44)/b14-12+,18-17+