methyl (2S,3S)-6,6-dimethyl-3-phenyl-1,4-dioxepane-2-carboxylate

Systemtic Name: methyl (2S,3S)-6,6-dimethyl-3-phenyl-1,4-dioxepane-2-carboxylate Openeye Name: methyl (2S,3S)-6,6-dimethyl-3-phenyl-1,4-dioxepane-2-carboxylate CAS Name: (2S,3S)-6,6-dimethyl-3-phenyl-1,4-dioxepane-2-carboxylic acid methyl ester IUPAC Name: methyl (2S,3S)-6,6-dimethyl-3-phenyl-1,4-dioxepane-2-carboxylate Traditional Name: (2S,3S)-6,6-dimethyl-3-phenyl-1,4-dioxepane-2-carboxylic acid methyl ester Formula: C15H20O4 MolecularWeight: 264.3169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(C(OC1)C(=O)OC)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CO[C@H]([C@H](OC1)C(=O)OC)C2=CC=CC=C2)C

InChI

InChI=1S/C15H20O4/c1-15(2)9-18-12(11-7-5-4-6-8-11)13(19-10-15)14(16)17-3/h4-8,12-13H,9-10H2,1-3H3/t12-,13-/m0/s1