[(4Z,6E)-3-methyl-2-oxidanylidene-1-oxacyclononadeca-4,6-dien-7-yl] ethanoate

Systemtic Name: [(4Z,6E)-3-methyl-2-oxidanylidene-1-oxacyclononadeca-4,6-dien-7-yl] ethanoate Openeye Name: [(4Z,6E)-3-methyl-2-oxo-1-oxacyclononadeca-4,6-dien-7-yl] acetate CAS Name: acetic acid [(4Z,6E)-3-methyl-2-oxo-1-oxacyclononadeca-4,6-dien-7-yl] ester IUPAC Name: [(4Z,6E)-3-methyl-2-oxo-1-oxacyclononadeca-4,6-dien-7-yl] acetate Traditional Name: acetic acid [(4Z,6E)-2-keto-3-methyl-1-oxacyclononadeca-4,6-dien-7-yl] ester Formula: C21H34O4 MolecularWeight: 350.49226

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC=C(CCCCCCCCCCCCOC1=O)OC(=O)C

Isomeric SMILES

CC1/C=C\C=C(/CCCCCCCCCCCCOC1=O)\OC(=O)C

InChI

InChI=1S/C21H34O4/c1-18-14-13-16-20(25-19(2)22)15-11-9-7-5-3-4-6-8-10-12-17-24-21(18)23/h13-14,16,18H,3-12,15,17H2,1-2H3/b14-13-,20-16+