[4-(4-bromanylbutyl)phenyl] 2-methyl-4-oxidanylidene-butanoate

Systemtic Name: [4-(4-bromanylbutyl)phenyl] 2-methyl-4-oxidanylidene-butanoate Openeye Name: [4-(4-bromobutyl)phenyl] 2-methyl-4-oxo-butanoate CAS Name: 2-methyl-4-oxobutanoic acid [4-(4-bromobutyl)phenyl] ester IUPAC Name: [4-(4-bromobutyl)phenyl] 2-methyl-4-oxobutanoate Traditional Name: 4-keto-2-methyl-butyric acid [4-(4-bromobutyl)phenyl] ester Formula: C15H19BrO3 MolecularWeight: 327.21356

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)C(=O)OC1=CC=C(C=C1)CCCCBr

Isomeric SMILES

CC(CC=O)C(=O)OC1=CC=C(C=C1)CCCCBr

InChI

InChI=1S/C15H19BrO3/c1-12(9-11-17)15(18)19-14-7-5-13(6-8-14)4-2-3-10-16/h5-8,11-12H,2-4,9-10H2,1H3