(2-methyl-5-oxidanylidene-5-phenyl-pent-3-yn-2-yl) benzoate

Systemtic Name: (2-methyl-5-oxidanylidene-5-phenyl-pent-3-yn-2-yl) benzoate Openeye Name: (1,1-dimethyl-4-oxo-4-phenyl-but-2-ynyl) benzoate CAS Name: benzoic acid (2-methyl-5-oxo-5-phenylpent-3-yn-2-yl) ester IUPAC Name: (2-methyl-5-oxo-5-phenylpent-3-yn-2-yl) benzoate Traditional Name: benzoic acid (4-keto-1,1-dimethyl-4-phenyl-but-2-ynyl) ester Formula: C19H16O3 MolecularWeight: 292.32854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C#CC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H16O3/c1-19(2,22-18(21)16-11-7-4-8-12-16)14-13-17(20)15-9-5-3-6-10-15/h3-12H,1-2H3