ethyl 2-[3-[(E)-2-ethyl-6-methyl-oct-5-enyl]-1-oxidanyl-cyclohex-2-en-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[(E)-2-ethyl-6-methyl-oct-5-enyl]-1-oxidanyl-cyclohex-2-en-1-yl]ethanoate Openeye Name: ethyl 2-[3-[(E)-2-ethyl-6-methyl-oct-5-enyl]-1-hydroxy-cyclohex-2-en-1-yl]acetate CAS Name: 2-[3-[(E)-2-ethyl-6-methyloct-5-enyl]-1-hydroxy-1-cyclohex-2-enyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(E)-2-ethyl-6-methyloct-5-enyl]-1-hydroxycyclohex-2-en-1-yl]acetate Traditional Name: 2-[3-[(E)-2-ethyl-6-methyl-oct-5-enyl]-1-hydroxy-cyclohex-2-en-1-yl]acetic acid ethyl ester Formula: C21H36O3 MolecularWeight: 336.50874

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC=C(C)CC)CC1=CC(CCC1)(CC(=O)OCC)O

Isomeric SMILES

CCC(CC/C=C(\C)/CC)CC1=CC(CCC1)(CC(=O)OCC)O

InChI

InChI=1S/C21H36O3/c1-5-17(4)10-8-11-18(6-2)14-19-12-9-13-21(23,15-19)16-20(22)24-7-3/h10,15,18,23H,5-9,11-14,16H2,1-4H3/b17-10+