2,5-dimethyl-7-(2-methylphenyl)hept-3-yne-2,5-diol

Systemtic Name: 2,5-dimethyl-7-(2-methylphenyl)hept-3-yne-2,5-diol Openeye Name: 2,5-dimethyl-7-(o-tolyl)hept-3-yne-2,5-diol CAS Name: 2,5-dimethyl-7-(2-methylphenyl)-3-heptyne-2,5-diol IUPAC Name: 2,5-dimethyl-7-(2-methylphenyl)hept-3-yne-2,5-diol Traditional Name: 2,5-dimethyl-7-(o-tolyl)hept-3-yne-2,5-diol Formula: C16H22O2 MolecularWeight: 246.34468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC(C)(C#CC(C)(C)O)O

Isomeric SMILES

CC1=CC=CC=C1CCC(C)(C#CC(C)(C)O)O

InChI

InChI=1S/C16H22O2/c1-13-7-5-6-8-14(13)9-10-16(4,18)12-11-15(2,3)17/h5-8,17-18H,9-10H2,1-4H3