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

Systemtic Name: methyl 5-methyl-2-oxidanyl-2-phenyl-hex-3-ynoate Openeye Name: methyl 2-hydroxy-5-methyl-2-phenyl-hex-3-ynoate CAS Name: 2-hydroxy-5-methyl-2-phenyl-3-hexynoic acid methyl ester IUPAC Name: methyl 2-hydroxy-5-methyl-2-phenylhex-3-ynoate Traditional Name: 2-hydroxy-5-methyl-2-phenyl-hex-3-ynoic acid methyl ester Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O3/c1-11(2)9-10-14(16,13(15)17-3)12-7-5-4-6-8-12/h4-8,11,16H,1-3H3