(3,4,5-trimethoxyphenyl)methyl 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: (3,4,5-trimethoxyphenyl)methyl 5-bromanyl-2-chloranyl-benzoate Openeye Name: (3,4,5-trimethoxyphenyl)methyl 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid (3,4,5-trimethoxyphenyl)methyl ester IUPAC Name: (3,4,5-trimethoxyphenyl)methyl 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid (3,4,5-trimethoxybenzyl) ester Formula: C17H16BrClO5 MolecularWeight: 415.66294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)COC(=O)C2=C(C=CC(=C2)Br)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)COC(=O)C2=C(C=CC(=C2)Br)Cl

InChI

InChI=1S/C17H16BrClO5/c1-21-14-6-10(7-15(22-2)16(14)23-3)9-24-17(20)12-8-11(18)4-5-13(12)19/h4-8H,9H2,1-3H3