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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)C(=C(C=C2)Br)O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)C(=C(C=C2)Br)O)NC(=O)C3=CC=CC=C3

InChI

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