ethyl 2-[(2-bromanyl-3,4,5-trimethoxy-phenyl)methyl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[(2-bromanyl-3,4,5-trimethoxy-phenyl)methyl]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(2-bromo-3,4,5-trimethoxy-phenyl)methyl]-3-oxo-butanoate CAS Name: 2-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]-3-oxobutanoate Traditional Name: 2-(2-bromo-3,4,5-trimethoxy-benzyl)-3-keto-butyric acid ethyl ester Formula: C16H21BrO6 MolecularWeight: 389.23834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C(=C1Br)OC)OC)OC)C(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CC(=C(C(=C1Br)OC)OC)OC)C(=O)C

InChI

InChI=1S/C16H21BrO6/c1-6-23-16(19)11(9(2)18)7-10-8-12(20-3)14(21-4)15(22-5)13(10)17/h8,11H,6-7H2,1-5H3