[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 2-(2-thienylsulfonylamino)benzoate CAS Name: 2-(thiophen-2-ylsulfonylamino)benzoic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-(2-thienylsulfonylamino)benzoic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C19H15IN2O5S2 MolecularWeight: 542.36727

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)I)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)I)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H15IN2O5S2/c20-13-5-3-6-14(11-13)21-17(23)12-27-19(24)15-7-1-2-8-16(15)22-29(25,26)18-9-4-10-28-18/h1-11,22H,12H2,(H,21,23)