3-(2-methylphenyl)but-1-yne-1,3-diol

Systemtic Name: 3-(2-methylphenyl)but-1-yne-1,3-diol Openeye Name: 3-(o-tolyl)but-1-yne-1,3-diol CAS Name: 3-(2-methylphenyl)-1-butyne-1,3-diol IUPAC Name: 3-(2-methylphenyl)but-1-yne-1,3-diol Traditional Name: 3-(o-tolyl)but-1-yne-1,3-diol Formula: C11H12O2 MolecularWeight: 176.21178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)(C#CO)O

Isomeric SMILES

CC1=CC=CC=C1C(C)(C#CO)O

InChI

InChI=1S/C11H12O2/c1-9-5-3-4-6-10(9)11(2,13)7-8-12/h3-6,12-13H,1-2H3