(4-bromanyl-2,6-dimethyl-phenyl) 3-methylbenzoate

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl) 3-methylbenzoate Openeye Name: (4-bromo-2,6-dimethyl-phenyl) 3-methylbenzoate CAS Name: 3-methylbenzoic acid (4-bromo-2,6-dimethylphenyl) ester IUPAC Name: (4-bromo-2,6-dimethylphenyl) 3-methylbenzoate Traditional Name: 3-methylbenzoic acid (4-bromo-2,6-dimethyl-phenyl) ester Formula: C16H15BrO2 MolecularWeight: 319.1931

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C16H15BrO2/c1-10-5-4-6-13(7-10)16(18)19-15-11(2)8-14(17)9-12(15)3/h4-9H,1-3H3