3-(hydroxymethyl)-2-(2-methylpent-2-en-3-ylsulfanylmethyl)cyclohexan-1-one

Systemtic Name: 3-(hydroxymethyl)-2-(2-methylpent-2-en-3-ylsulfanylmethyl)cyclohexan-1-one Openeye Name: 2-[(1-ethyl-2-methyl-prop-1-enyl)sulfanylmethyl]-3-(hydroxymethyl)cyclohexanone CAS Name: 3-(hydroxymethyl)-2-[(2-methylpent-2-en-3-ylthio)methyl]-1-cyclohexanone IUPAC Name: 3-(hydroxymethyl)-2-(2-methylpent-2-en-3-ylsulfanylmethyl)cyclohexan-1-one Traditional Name: 2-[[(1-ethyl-2-methyl-prop-1-enyl)thio]methyl]-3-methylol-cyclohexanone Formula: C14H24O2S MolecularWeight: 256.40416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C)C)SCC1C(CCCC1=O)CO

Isomeric SMILES

CCC(=C(C)C)SCC1C(CCCC1=O)CO

InChI

InChI=1S/C14H24O2S/c1-4-14(10(2)3)17-9-12-11(8-15)6-5-7-13(12)16/h11-12,15H,4-9H2,1-3H3