methyl (E)-4,4-dimethyl-5-oxidanylidene-3-phenyl-pent-2-enoate

Systemtic Name: methyl (E)-4,4-dimethyl-5-oxidanylidene-3-phenyl-pent-2-enoate Openeye Name: methyl (E)-4,4-dimethyl-5-oxo-3-phenyl-pent-2-enoate CAS Name: (E)-4,4-dimethyl-5-oxo-3-phenyl-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-4,4-dimethyl-5-oxo-3-phenylpent-2-enoate Traditional Name: (E)-5-keto-4,4-dimethyl-3-phenyl-pent-2-enoic acid methyl ester Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O3/c1-14(2,10-15)12(9-13(16)17-3)11-7-5-4-6-8-11/h4-10H,1-3H3/b12-9+