methyl 5,5-dimethyl-2-oxidanyl-2-phenyl-hex-3-ynoate

Systemtic Name: methyl 5,5-dimethyl-2-oxidanyl-2-phenyl-hex-3-ynoate Openeye Name: methyl 2-hydroxy-5,5-dimethyl-2-phenyl-hex-3-ynoate CAS Name: 2-hydroxy-5,5-dimethyl-2-phenyl-3-hexynoic acid methyl ester IUPAC Name: methyl 2-hydroxy-5,5-dimethyl-2-phenylhex-3-ynoate Traditional Name: 2-hydroxy-5,5-dimethyl-2-phenyl-hex-3-ynoic acid methyl ester Formula: C15H18O3 MolecularWeight: 246.30162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18O3/c1-14(2,3)10-11-15(17,13(16)18-4)12-8-6-5-7-9-12/h5-9,17H,1-4H3