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

Systemtic Name: (phenylmethyl) 3-bromanyl-4-methyl-benzoate Openeye Name: benzyl 3-bromo-4-methyl-benzoate CAS Name: 3-bromo-4-methylbenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-bromo-4-methylbenzoate Traditional Name: 3-bromo-4-methyl-benzoic acid benzyl ester Formula: C15H13BrO2 MolecularWeight: 305.16652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)Br

InChI

InChI=1S/C15H13BrO2/c1-11-7-8-13(9-14(11)16)15(17)18-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3