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

Systemtic Name: [5-methyl-1-(9-oxidanyldecyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-yl] ethanoate Openeye Name: [1-(9-hydroxydecyl)-5-methyl-6-oxo-cyclohexa-2,4-dien-1-yl] acetate CAS Name: acetic acid [1-(9-hydroxydecyl)-5-methyl-6-oxo-1-cyclohexa-2,4-dienyl] ester IUPAC Name: [1-(9-hydroxydecyl)-5-methyl-6-oxocyclohexa-2,4-dien-1-yl] acetate Traditional Name: acetic acid [1-(9-hydroxydecyl)-6-keto-5-methyl-cyclohexa-2,4-dien-1-yl] ester Formula: C19H30O4 MolecularWeight: 322.4391

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30O4/c1-15-11-10-14-19(18(15)22,23-17(3)21)13-9-7-5-4-6-8-12-16(2)20/h10-11,14,16,20H,4-9,12-13H2,1-3H3