(6-oxidanylidene-2-phenyl-cyclohexen-1-yl) 2,2-dimethylpropanoate

Systemtic Name: (6-oxidanylidene-2-phenyl-cyclohexen-1-yl) 2,2-dimethylpropanoate Openeye Name: (6-oxo-2-phenyl-cyclohexen-1-yl) 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid (6-oxo-2-phenyl-1-cyclohexenyl) ester IUPAC Name: (6-oxo-2-phenylcyclohexen-1-yl) 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid (6-keto-2-phenyl-cyclohexen-1-yl) ester Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=C(CCCC1=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)OC1=C(CCCC1=O)C2=CC=CC=C2

InChI

InChI=1S/C17H20O3/c1-17(2,3)16(19)20-15-13(10-7-11-14(15)18)12-8-5-4-6-9-12/h4-6,8-9H,7,10-11H2,1-3H3