ethyl 4-bromanyl-5-[oxidanyl(phenyl)methyl]thiophene-2-carboxylate

Systemtic Name: ethyl 4-bromanyl-5-[oxidanyl(phenyl)methyl]thiophene-2-carboxylate Openeye Name: ethyl 4-bromo-5-[hydroxy(phenyl)methyl]thiophene-2-carboxylate CAS Name: 4-bromo-5-[hydroxy(phenyl)methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-bromo-5-[hydroxy(phenyl)methyl]thiophene-2-carboxylate Traditional Name: 4-bromo-5-[hydroxy(phenyl)methyl]thiophene-2-carboxylic acid ethyl ester Formula: C14H13BrO3S MolecularWeight: 341.22022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(S1)C(C2=CC=CC=C2)O)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(S1)C(C2=CC=CC=C2)O)Br

InChI

InChI=1S/C14H13BrO3S/c1-2-18-14(17)11-8-10(15)13(19-11)12(16)9-6-4-3-5-7-9/h3-8,12,16H,2H2,1H3