ethyl (2E)-2-[3-(2-ethyl-5-methyl-5-methylsulfanyl-heptyl)cyclohex-2-en-1-ylidene]ethanoate

Systemtic Name: ethyl (2E)-2-[3-(2-ethyl-5-methyl-5-methylsulfanyl-heptyl)cyclohex-2-en-1-ylidene]ethanoate Openeye Name: ethyl (2E)-2-[3-(2-ethyl-5-methyl-5-methylsulfanyl-heptyl)cyclohex-2-en-1-ylidene]acetate CAS Name: (2E)-2-[3-[2-ethyl-5-methyl-5-(methylthio)heptyl]-1-cyclohex-2-enylidene]acetic acid ethyl ester IUPAC Name: ethyl (2E)-2-[3-(2-ethyl-5-methyl-5-methylsulfanylheptyl)cyclohex-2-en-1-ylidene]acetate Traditional Name: (2E)-2-[3-[2-ethyl-5-methyl-5-(methylthio)heptyl]cyclohex-2-en-1-ylidene]acetic acid ethyl ester Formula: C21H36O2S MolecularWeight: 352.57434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H36O2S/c1-6-17(12-13-21(4,7-2)24-5)14-18-10-9-11-19(15-18)16-20(22)23-8-3/h15-17H,6-14H2,1-5H3/b19-16+