(4-bromanyl-2-propanoyl-phenyl) 2,3-dimethylbenzoate

Systemtic Name: (4-bromanyl-2-propanoyl-phenyl) 2,3-dimethylbenzoate Openeye Name: (4-bromo-2-propanoyl-phenyl) 2,3-dimethylbenzoate CAS Name: 2,3-dimethylbenzoic acid [4-bromo-2-(1-oxopropyl)phenyl] ester IUPAC Name: (4-bromo-2-propanoylphenyl) 2,3-dimethylbenzoate Traditional Name: 2,3-dimethylbenzoic acid (4-bromo-2-propionyl-phenyl) ester Formula: C18H17BrO3 MolecularWeight: 361.22978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrO3/c1-4-16(20)15-10-13(19)8-9-17(15)22-18(21)14-7-5-6-11(2)12(14)3/h5-10H,4H2,1-3H3