4-(3-thiophen-2-ylsulfonylpropanoylamino)benzoate

Systemtic Name: 4-(3-thiophen-2-ylsulfonylpropanoylamino)benzoate Openeye Name: 4-[3-(2-thienylsulfonyl)propanoylamino]benzoate CAS Name: 4-[(1-oxo-3-thiophen-2-ylsulfonylpropyl)amino]benzoate IUPAC Name: 4-(3-thiophen-2-ylsulfonylpropanoylamino)benzoate Traditional Name: 4-[3-(2-thienylsulfonyl)propanoylamino]benzoate Formula: C14H12NO5S2- MolecularWeight: 338.37878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)S(=O)(=O)CCC(=O)NC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

C1=CSC(=C1)S(=O)(=O)CCC(=O)NC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C14H13NO5S2/c16-12(7-9-22(19,20)13-2-1-8-21-13)15-11-5-3-10(4-6-11)14(17)18/h1-6,8H,7,9H2,(H,15,16)(H,17,18)/p-1