(2-oxidanylidene-4-phenyl-butyl) 4-bromanylbenzoate

Systemtic Name: (2-oxidanylidene-4-phenyl-butyl) 4-bromanylbenzoate Openeye Name: (2-oxo-4-phenyl-butyl) 4-bromobenzoate CAS Name: 4-bromobenzoic acid (2-oxo-4-phenylbutyl) ester IUPAC Name: (2-oxo-4-phenylbutyl) 4-bromobenzoate Traditional Name: 4-bromobenzoic acid (2-keto-4-phenyl-butyl) ester Formula: C17H15BrO3 MolecularWeight: 347.2032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)COC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)COC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H15BrO3/c18-15-9-7-14(8-10-15)17(20)21-12-16(19)11-6-13-4-2-1-3-5-13/h1-5,7-10H,6,11-12H2