(4-bromophenyl)methyl 3-oxidanylideneheptanoate

Systemtic Name: (4-bromophenyl)methyl 3-oxidanylideneheptanoate Openeye Name: (4-bromophenyl)methyl 3-oxoheptanoate CAS Name: 3-oxoheptanoic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 3-oxoheptanoate Traditional Name: 3-ketoenanthic acid (4-bromobenzyl) ester Formula: C14H17BrO3 MolecularWeight: 313.18698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)CC(=O)OCC1=CC=C(C=C1)Br

Isomeric SMILES

CCCCC(=O)CC(=O)OCC1=CC=C(C=C1)Br

InChI

InChI=1S/C14H17BrO3/c1-2-3-4-13(16)9-14(17)18-10-11-5-7-12(15)8-6-11/h5-8H,2-4,9-10H2,1H3