2-[(3,4-dimethylphenyl)methyl]propane-1,3-diol

Systemtic Name: 2-[(3,4-dimethylphenyl)methyl]propane-1,3-diol Openeye Name: 2-[(3,4-dimethylphenyl)methyl]propane-1,3-diol CAS Name: 2-[(3,4-dimethylphenyl)methyl]propane-1,3-diol IUPAC Name: 2-[(3,4-dimethylphenyl)methyl]propane-1,3-diol Traditional Name: 2-(3,4-dimethylbenzyl)propane-1,3-diol Formula: C12H18O2 MolecularWeight: 194.27012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18O2/c1-9-3-4-11(5-10(9)2)6-12(7-13)8-14/h3-5,12-14H,6-8H2,1-2H3