methyl 4-(4-bromophenyl)-2,2-dimethyl-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(4-bromophenyl)-2,2-dimethyl-4-oxidanylidene-butanoate Openeye Name: methyl 4-(4-bromophenyl)-2,2-dimethyl-4-oxo-butanoate CAS Name: 4-(4-bromophenyl)-2,2-dimethyl-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2,2-dimethyl-4-oxobutanoate Traditional Name: 4-(4-bromophenyl)-4-keto-2,2-dimethyl-butyric acid methyl ester Formula: C13H15BrO3 MolecularWeight: 299.1604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrO3/c1-13(2,12(16)17-3)8-11(15)9-4-6-10(14)7-5-9/h4-7H,8H2,1-3H3