(4R,5S)-4-[(E)-but-2-enyl]-5-(hydroxymethyl)-3,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: (4R,5S)-4-[(E)-but-2-enyl]-5-(hydroxymethyl)-3,5-dimethyl-cyclohex-2-en-1-one Openeye Name: (4R,5S)-4-[(E)-but-2-enyl]-5-(hydroxymethyl)-3,5-dimethyl-cyclohex-2-en-1-one CAS Name: (4R,5S)-4-[(E)-but-2-enyl]-5-(hydroxymethyl)-3,5-dimethyl-1-cyclohex-2-enone IUPAC Name: (4R,5S)-4-[(E)-but-2-enyl]-5-(hydroxymethyl)-3,5-dimethylcyclohex-2-en-1-one Traditional Name: (4R,5S)-4-[(E)-but-2-enyl]-3,5-dimethyl-5-methylol-cyclohex-2-en-1-one Formula: C13H20O2 MolecularWeight: 208.2967

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC1C(=CC(=O)CC1(C)CO)C

Isomeric SMILES

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

InChI

InChI=1S/C13H20O2/c1-4-5-6-12-10(2)7-11(15)8-13(12,3)9-14/h4-5,7,12,14H,6,8-9H2,1-3H3/b5-4+/t12-,13-/m1/s1