[(1S,4S,6S)-4-(2-chloranylpropan-2-yl)-6-methyl-6-oxidanyl-cyclohex-2-en-1-yl] ethanoate

Systemtic Name: [(1S,4S,6S)-4-(2-chloranylpropan-2-yl)-6-methyl-6-oxidanyl-cyclohex-2-en-1-yl] ethanoate Openeye Name: [(1S,4S,6S)-4-(1-chloro-1-methyl-ethyl)-6-hydroxy-6-methyl-cyclohex-2-en-1-yl] acetate CAS Name: acetic acid [(1S,4S,6S)-4-(2-chloropropan-2-yl)-6-hydroxy-6-methyl-1-cyclohex-2-enyl] ester IUPAC Name: [(1S,4S,6S)-4-(2-chloropropan-2-yl)-6-hydroxy-6-methylcyclohex-2-en-1-yl] acetate Traditional Name: acetic acid [(1S,4S,6S)-4-(1-chloro-1-methyl-ethyl)-6-hydroxy-6-methyl-cyclohex-2-en-1-yl] ester Formula: C12H19ClO3 MolecularWeight: 246.73046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=CC(CC1(C)O)C(C)(C)Cl

Isomeric SMILES

CC(=O)O[C@H]1C=C[C@H](C[C@]1(C)O)C(C)(C)Cl

InChI

InChI=1S/C12H19ClO3/c1-8(14)16-10-6-5-9(11(2,3)13)7-12(10,4)15/h5-6,9-10,15H,7H2,1-4H3/t9-,10+,12+/m1/s1