ethyl 2-benzamido-6-bromanyl-7-oxidanyl-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-benzamido-6-bromanyl-7-oxidanyl-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-benzamido-6-bromo-7-hydroxy-benzothiophene-3-carboxylate CAS Name: 2-benzamido-6-bromo-7-hydroxy-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-benzamido-6-bromo-7-hydroxy-1-benzothiophene-3-carboxylate Traditional Name: 2-benzamido-6-bromo-7-hydroxy-benzothiophene-3-carboxylic acid ethyl ester Formula: C18H14BrNO4S MolecularWeight: 420.27706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1C=CC(=C2O)Br)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1C=CC(=C2O)Br)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H14BrNO4S/c1-2-24-18(23)13-11-8-9-12(19)14(21)15(11)25-17(13)20-16(22)10-6-4-3-5-7-10/h3-9,21H,2H2,1H3,(H,20,22)