(5,5-dimethyl-1-oxidanylidene-1,2-diphenyl-hex-3-yn-2-yl) ethanoate

Systemtic Name: (5,5-dimethyl-1-oxidanylidene-1,2-diphenyl-hex-3-yn-2-yl) ethanoate Openeye Name: (1-benzoyl-4,4-dimethyl-1-phenyl-pent-2-ynyl) acetate CAS Name: acetic acid (5,5-dimethyl-1-oxo-1,2-diphenylhex-3-yn-2-yl) ester IUPAC Name: (5,5-dimethyl-1-oxo-1,2-diphenylhex-3-yn-2-yl) acetate Traditional Name: acetic acid (1-benzoyl-4,4-dimethyl-1-phenyl-pent-2-ynyl) ester Formula: C22H22O3 MolecularWeight: 334.40828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22O3/c1-17(23)25-22(16-15-21(2,3)4,19-13-9-6-10-14-19)20(24)18-11-7-5-8-12-18/h5-14H,1-4H3