(2-methylphenyl) 3-bromanyl-4-propoxy-benzoate

Systemtic Name: (2-methylphenyl) 3-bromanyl-4-propoxy-benzoate Openeye Name: o-tolyl 3-bromo-4-propoxy-benzoate CAS Name: 3-bromo-4-propoxybenzoic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 3-bromo-4-propoxybenzoate Traditional Name: 3-bromo-4-propoxy-benzoic acid o-tolyl ester Formula: C17H17BrO3 MolecularWeight: 349.21908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2C)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2C)Br

InChI

InChI=1S/C17H17BrO3/c1-3-10-20-16-9-8-13(11-14(16)18)17(19)21-15-7-5-4-6-12(15)2/h4-9,11H,3,10H2,1-2H3