methyl 5-methyl-6-oxidanylidene-6-phenyl-hex-2-ynoate

Systemtic Name: methyl 5-methyl-6-oxidanylidene-6-phenyl-hex-2-ynoate Openeye Name: methyl 5-methyl-6-oxo-6-phenyl-hex-2-ynoate CAS Name: 5-methyl-6-oxo-6-phenyl-2-hexynoic acid methyl ester IUPAC Name: methyl 5-methyl-6-oxo-6-phenylhex-2-ynoate Traditional Name: 6-keto-5-methyl-6-phenyl-hex-2-ynoic acid methyl ester Formula: C14H14O3 MolecularWeight: 230.25916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14O3/c1-11(7-6-10-13(15)17-2)14(16)12-8-4-3-5-9-12/h3-5,8-9,11H,7H2,1-2H3