(3-propanoylphenyl) 3-bromanyl-4-methyl-benzoate

Systemtic Name: (3-propanoylphenyl) 3-bromanyl-4-methyl-benzoate Openeye Name: (3-propanoylphenyl) 3-bromo-4-methyl-benzoate CAS Name: 3-bromo-4-methylbenzoic acid [3-(1-oxopropyl)phenyl] ester IUPAC Name: (3-propanoylphenyl) 3-bromo-4-methylbenzoate Traditional Name: 3-bromo-4-methyl-benzoic acid (3-propionylphenyl) ester Formula: C17H15BrO3 MolecularWeight: 347.2032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrO3/c1-3-16(19)12-5-4-6-14(9-12)21-17(20)13-8-7-11(2)15(18)10-13/h4-10H,3H2,1-2H3