(phenylmethyl) 2-[1-(2-bromophenyl)ethyl]-3-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) 2-[1-(2-bromophenyl)ethyl]-3-oxidanylidene-butanoate Openeye Name: benzyl 2-acetyl-3-(2-bromophenyl)butanoate CAS Name: 2-acetyl-3-(2-bromophenyl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-acetyl-3-(2-bromophenyl)butanoate Traditional Name: 2-acetyl-3-(2-bromophenyl)butyric acid benzyl ester Formula: C19H19BrO3 MolecularWeight: 375.25636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)C(C(=O)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C1=CC=CC=C1Br)C(C(=O)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H19BrO3/c1-13(16-10-6-7-11-17(16)20)18(14(2)21)19(22)23-12-15-8-4-3-5-9-15/h3-11,13,18H,12H2,1-2H3