2-[(E)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanylcyclohexan-1-one

Systemtic Name: 2-[(E)-2-oxidanyl-4-oxidanylidene-pent-2-en-3-yl]sulfanylcyclohexan-1-one Openeye Name: 2-[(E)-1-acetyl-2-hydroxy-prop-1-enyl]sulfanylcyclohexanone CAS Name: 2-[[(E)-2-hydroxy-4-oxopent-2-en-3-yl]thio]-1-cyclohexanone IUPAC Name: 2-[(E)-2-hydroxy-4-oxopent-2-en-3-yl]sulfanylcyclohexan-1-one Traditional Name: 2-[[(E)-1-acetyl-2-hydroxy-prop-1-enyl]thio]cyclohexanone Formula: C11H16O3S MolecularWeight: 228.30794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)C)SC1CCCCC1=O)O

Isomeric SMILES

C/C(=C(/C(=O)C)\SC1CCCCC1=O)/O

InChI

InChI=1S/C11H16O3S/c1-7(12)11(8(2)13)15-10-6-4-3-5-9(10)14/h10,12H,3-6H2,1-2H3/b11-7+