(2S,3R)-3-methoxy-2-phenylmethoxy-cyclohexan-1-one

Systemtic Name: (2S,3R)-3-methoxy-2-phenylmethoxy-cyclohexan-1-one Openeye Name: (2S,3R)-2-benzyloxy-3-methoxy-cyclohexanone CAS Name: (2S,3R)-3-methoxy-2-phenylmethoxy-1-cyclohexanone IUPAC Name: (2S,3R)-3-methoxy-2-phenylmethoxycyclohexan-1-one Traditional Name: (2S,3R)-2-benzoxy-3-methoxy-cyclohexanone Formula: C14H18O3 MolecularWeight: 234.29092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CCCC(=O)C1OCC2=CC=CC=C2

Isomeric SMILES

CO[C@@H]1CCCC(=O)[C@H]1OCC2=CC=CC=C2

InChI

InChI=1S/C14H18O3/c1-16-13-9-5-8-12(15)14(13)17-10-11-6-3-2-4-7-11/h2-4,6-7,13-14H,5,8-10H2,1H3/t13-,14-/m1/s1