(4-acetamidophenyl) 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (4-acetamidophenyl) 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (4-acetamidophenyl) 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (4-acetamidophenyl) ester Formula: C17H12ClNO3S MolecularWeight: 345.80008

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H12ClNO3S/c1-10(20)19-11-6-8-12(9-7-11)22-17(21)16-15(18)13-4-2-3-5-14(13)23-16/h2-9H,1H3,(H,19,20)