5,5-dimethyl-1-phenyl-hex-3-yne-1,2-diol

Systemtic Name: 5,5-dimethyl-1-phenyl-hex-3-yne-1,2-diol Openeye Name: 5,5-dimethyl-1-phenyl-hex-3-yne-1,2-diol CAS Name: 5,5-dimethyl-1-phenyl-3-hexyne-1,2-diol IUPAC Name: 5,5-dimethyl-1-phenylhex-3-yne-1,2-diol Traditional Name: 5,5-dimethyl-1-phenyl-hex-3-yne-1,2-diol Formula: C14H18O2 MolecularWeight: 218.29152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC(C(C1=CC=CC=C1)O)O

Isomeric SMILES

CC(C)(C)C#CC(C(C1=CC=CC=C1)O)O

InChI

InChI=1S/C14H18O2/c1-14(2,3)10-9-12(15)13(16)11-7-5-4-6-8-11/h4-8,12-13,15-16H,1-3H3