[5-(4-chlorophenyl)sulfonyl-2-nitro-phenyl] 1-benzothiophene-2-carboxylate

Systemtic Name: [5-(4-chlorophenyl)sulfonyl-2-nitro-phenyl] 1-benzothiophene-2-carboxylate Openeye Name: [5-(4-chlorophenyl)sulfonyl-2-nitro-phenyl] benzothiophene-2-carboxylate CAS Name: 1-benzothiophene-2-carboxylic acid [5-(4-chlorophenyl)sulfonyl-2-nitrophenyl] ester IUPAC Name: [5-(4-chlorophenyl)sulfonyl-2-nitrophenyl] 1-benzothiophene-2-carboxylate Traditional Name: benzothiophene-2-carboxylic acid [5-(4-chlorophenyl)sulfonyl-2-nitro-phenyl] ester Formula: C21H12ClNO6S2 MolecularWeight: 473.90608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)C(=O)OC3=C(C=CC(=C3)S(=O)(=O)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)C(=O)OC3=C(C=CC(=C3)S(=O)(=O)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H12ClNO6S2/c22-14-5-7-15(8-6-14)31(27,28)16-9-10-17(23(25)26)18(12-16)29-21(24)20-11-13-3-1-2-4-19(13)30-20/h1-12H