(2S,3S,4S)-4-(hydroxymethyl)-2-methoxy-3-[(E)-6-methylhept-2-en-2-yl]cyclohexan-1-one

Systemtic Name: (2S,3S,4S)-4-(hydroxymethyl)-2-methoxy-3-[(E)-6-methylhept-2-en-2-yl]cyclohexan-1-one Openeye Name: (2S,3S,4S)-3-[(E)-1,5-dimethylhex-1-enyl]-4-(hydroxymethyl)-2-methoxy-cyclohexanone CAS Name: (2S,3S,4S)-4-(hydroxymethyl)-2-methoxy-3-[(E)-6-methylhept-2-en-2-yl]-1-cyclohexanone IUPAC Name: (2S,3S,4S)-4-(hydroxymethyl)-2-methoxy-3-[(E)-6-methylhept-2-en-2-yl]cyclohexan-1-one Traditional Name: (2S,3S,4S)-3-[(E)-1,5-dimethylhex-1-enyl]-2-methoxy-4-methylol-cyclohexanone Formula: C16H28O3 MolecularWeight: 268.39172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC=C(C)C1C(CCC(=O)C1OC)CO

Isomeric SMILES

CC(C)CC/C=C(\C)/[C@@H]1[C@H](CCC(=O)[C@H]1OC)CO

InChI

InChI=1S/C16H28O3/c1-11(2)6-5-7-12(3)15-13(10-17)8-9-14(18)16(15)19-4/h7,11,13,15-17H,5-6,8-10H2,1-4H3/b12-7+/t13-,15-,16-/m1/s1