[1-(9-oxidanyldecyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-yl] ethanoate

Systemtic Name: [1-(9-oxidanyldecyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-yl] ethanoate Openeye Name: [1-(9-hydroxydecyl)-6-oxo-cyclohexa-2,4-dien-1-yl] acetate CAS Name: acetic acid [1-(9-hydroxydecyl)-6-oxo-1-cyclohexa-2,4-dienyl] ester IUPAC Name: [1-(9-hydroxydecyl)-6-oxocyclohexa-2,4-dien-1-yl] acetate Traditional Name: acetic acid [1-(9-hydroxydecyl)-6-keto-cyclohexa-2,4-dien-1-yl] ester Formula: C18H28O4 MolecularWeight: 308.41252

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCC1(C=CC=CC1=O)OC(=O)C)O

Isomeric SMILES

CC(CCCCCCCCC1(C=CC=CC1=O)OC(=O)C)O

InChI

InChI=1S/C18H28O4/c1-15(19)11-7-5-3-4-6-9-13-18(22-16(2)20)14-10-8-12-17(18)21/h8,10,12,14-15,19H,3-7,9,11,13H2,1-2H3