methyl 3-(5-bromanyl-2-oxidanyl-phenyl)-2,3-bis(oxidanyl)-2-phenyl-propanoate

Systemtic Name: methyl 3-(5-bromanyl-2-oxidanyl-phenyl)-2,3-bis(oxidanyl)-2-phenyl-propanoate Openeye Name: methyl 3-(5-bromo-2-hydroxy-phenyl)-2,3-dihydroxy-2-phenyl-propanoate CAS Name: 3-(5-bromo-2-hydroxyphenyl)-2,3-dihydroxy-2-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-(5-bromo-2-hydroxyphenyl)-2,3-dihydroxy-2-phenylpropanoate Traditional Name: 3-(5-bromo-2-hydroxy-phenyl)-2,3-dihydroxy-2-phenyl-propionic acid methyl ester Formula: C16H15BrO5 MolecularWeight: 367.1913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)(C(C2=C(C=CC(=C2)Br)O)O)O

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)(C(C2=C(C=CC(=C2)Br)O)O)O

InChI

InChI=1S/C16H15BrO5/c1-22-15(20)16(21,10-5-3-2-4-6-10)14(19)12-9-11(17)7-8-13(12)18/h2-9,14,18-19,21H,1H3