(4-propanoylphenyl) 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: (4-propanoylphenyl) 5-bromanyl-2-chloranyl-benzoate Openeye Name: (4-propanoylphenyl) 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid (4-propionylphenyl) ester Formula: C16H12BrClO3 MolecularWeight: 367.62168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)Br)Cl

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)Br)Cl

InChI

InChI=1S/C16H12BrClO3/c1-2-15(19)10-3-6-12(7-4-10)21-16(20)13-9-11(17)5-8-14(13)18/h3-9H,2H2,1H3