(3-methylphenyl) 3-bromanyl-4-hexoxy-benzoate

Systemtic Name: (3-methylphenyl) 3-bromanyl-4-hexoxy-benzoate Openeye Name: m-tolyl 3-bromo-4-hexoxy-benzoate CAS Name: 3-bromo-4-hexoxybenzoic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 3-bromo-4-hexoxybenzoate Traditional Name: 3-bromo-4-hexoxy-benzoic acid m-tolyl ester Formula: C20H23BrO3 MolecularWeight: 391.29882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)C)Br

InChI

InChI=1S/C20H23BrO3/c1-3-4-5-6-12-23-19-11-10-16(14-18(19)21)20(22)24-17-9-7-8-15(2)13-17/h7-11,13-14H,3-6,12H2,1-2H3