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

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl) 3-ethoxybenzoate Openeye Name: (4-bromo-2,6-dimethyl-phenyl) 3-ethoxybenzoate CAS Name: 3-ethoxybenzoic acid (4-bromo-2,6-dimethylphenyl) ester IUPAC Name: (4-bromo-2,6-dimethylphenyl) 3-ethoxybenzoate Traditional Name: 3-ethoxybenzoic acid (4-bromo-2,6-dimethyl-phenyl) ester Formula: C17H17BrO3 MolecularWeight: 349.21908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C17H17BrO3/c1-4-20-15-7-5-6-13(10-15)17(19)21-16-11(2)8-14(18)9-12(16)3/h5-10H,4H2,1-3H3