[(4E)-4-[1-(4-hydroxyphenyl)propan-2-ylidene]cyclohexa-1,5-dien-1-yl] 12-oxidanylidenedodecanoate

Systemtic Name: [(4E)-4-[1-(4-hydroxyphenyl)propan-2-ylidene]cyclohexa-1,5-dien-1-yl] 12-oxidanylidenedodecanoate Openeye Name: [(4E)-4-[2-(4-hydroxyphenyl)-1-methyl-ethylidene]cyclohexa-1,5-dien-1-yl] 12-oxododecanoate CAS Name: 12-oxododecanoic acid [(4E)-4-[1-(4-hydroxyphenyl)propan-2-ylidene]-1-cyclohexa-1,5-dienyl] ester IUPAC Name: [(4E)-4-[1-(4-hydroxyphenyl)propan-2-ylidene]cyclohexa-1,5-dien-1-yl] 12-oxododecanoate Traditional Name: 12-ketolauric acid [(4E)-4-[2-(4-hydroxyphenyl)-1-methyl-ethylidene]cyclohexa-1,5-dien-1-yl] ester Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1CC=C(C=C1)OC(=O)CCCCCCCCCCC=O)CC2=CC=C(C=C2)O

Isomeric SMILES

C/C(=C\1/CC=C(C=C1)OC(=O)CCCCCCCCCCC=O)/CC2=CC=C(C=C2)O

InChI

InChI=1S/C27H36O4/c1-22(21-23-12-16-25(29)17-13-23)24-14-18-26(19-15-24)31-27(30)11-9-7-5-3-2-4-6-8-10-20-28/h12-14,16-20,29H,2-11,15,21H2,1H3/b24-22-