(2S,3R,6R)-6-(4-methylphenyl)heptane-1,2,3,6-tetrol

Systemtic Name: (2S,3R,6R)-6-(4-methylphenyl)heptane-1,2,3,6-tetrol Openeye Name: (2S,3R,6R)-6-(p-tolyl)heptane-1,2,3,6-tetrol CAS Name: (2S,3R,6R)-6-(4-methylphenyl)heptane-1,2,3,6-tetrol IUPAC Name: (2S,3R,6R)-6-(4-methylphenyl)heptane-1,2,3,6-tetrol Traditional Name: (2S,3R,6R)-6-(p-tolyl)heptane-1,2,3,6-tetrol Formula: C14H22O4 MolecularWeight: 254.32208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)(CCC(C(CO)O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)[C@@](C)(CC[C@H]([C@H](CO)O)O)O

InChI

InChI=1S/C14H22O4/c1-10-3-5-11(6-4-10)14(2,18)8-7-12(16)13(17)9-15/h3-6,12-13,15-18H,7-9H2,1-2H3/t12-,13+,14-/m1/s1