[5-methyl-1-(7-oxidanylheptyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-yl] ethanoate

Systemtic Name: [5-methyl-1-(7-oxidanylheptyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-yl] ethanoate Openeye Name: [1-(7-hydroxyheptyl)-5-methyl-6-oxo-cyclohexa-2,4-dien-1-yl] acetate CAS Name: acetic acid [1-(7-hydroxyheptyl)-5-methyl-6-oxo-1-cyclohexa-2,4-dienyl] ester IUPAC Name: [1-(7-hydroxyheptyl)-5-methyl-6-oxocyclohexa-2,4-dien-1-yl] acetate Traditional Name: acetic acid [1-(7-hydroxyheptyl)-6-keto-5-methyl-cyclohexa-2,4-dien-1-yl] ester Formula: C16H24O4 MolecularWeight: 280.35936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(C1=O)(CCCCCCCO)OC(=O)C

Isomeric SMILES

CC1=CC=CC(C1=O)(CCCCCCCO)OC(=O)C

InChI

InChI=1S/C16H24O4/c1-13-9-8-11-16(15(13)19,20-14(2)18)10-6-4-3-5-7-12-17/h8-9,11,17H,3-7,10,12H2,1-2H3