[1-methanoyl-3-(4-methoxy-4-oxidanylidene-butyl)-2,2,4-trimethyl-cyclohex-3-en-1-yl] hexanoate

Systemtic Name: [1-methanoyl-3-(4-methoxy-4-oxidanylidene-butyl)-2,2,4-trimethyl-cyclohex-3-en-1-yl] hexanoate Openeye Name: [1-formyl-3-(4-methoxy-4-oxo-butyl)-2,2,4-trimethyl-cyclohex-3-en-1-yl] hexanoate CAS Name: hexanoic acid [1-formyl-3-(4-methoxy-4-oxobutyl)-2,2,4-trimethyl-1-cyclohex-3-enyl] ester IUPAC Name: [1-formyl-3-(4-methoxy-4-oxobutyl)-2,2,4-trimethylcyclohex-3-en-1-yl] hexanoate Traditional Name: hexanoic acid [1-formyl-3-(4-keto-4-methoxy-butyl)-2,2,4-trimethyl-cyclohex-3-en-1-yl] ester Formula: C21H34O5 MolecularWeight: 366.49166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1(CCC(=C(C1(C)C)CCCC(=O)OC)C)C=O

Isomeric SMILES

CCCCCC(=O)OC1(CCC(=C(C1(C)C)CCCC(=O)OC)C)C=O

InChI

InChI=1S/C21H34O5/c1-6-7-8-11-19(24)26-21(15-22)14-13-16(2)17(20(21,3)4)10-9-12-18(23)25-5/h15H,6-14H2,1-5H3