15-(2,6,6-trimethyl-3-oxidanylidene-cyclohexen-1-yl)pentadecan-4-yl ethanoate

Systemtic Name: 15-(2,6,6-trimethyl-3-oxidanylidene-cyclohexen-1-yl)pentadecan-4-yl ethanoate Openeye Name: [1-propyl-12-(2,6,6-trimethyl-3-oxo-cyclohexen-1-yl)dodecyl] acetate CAS Name: acetic acid 15-(2,6,6-trimethyl-3-oxo-1-cyclohexenyl)pentadecan-4-yl ester IUPAC Name: 15-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)pentadecan-4-yl acetate Traditional Name: acetic acid [12-(3-keto-2,6,6-trimethyl-cyclohexen-1-yl)-1-propyl-dodecyl] ester Formula: C26H46O3 MolecularWeight: 406.64164

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCCCCCCCCCC1=C(C(=O)CCC1(C)C)C)OC(=O)C

Isomeric SMILES

CCCC(CCCCCCCCCCCC1=C(C(=O)CCC1(C)C)C)OC(=O)C

InChI

InChI=1S/C26H46O3/c1-6-16-23(29-22(3)27)17-14-12-10-8-7-9-11-13-15-18-24-21(2)25(28)19-20-26(24,4)5/h23H,6-20H2,1-5H3