3-[4-(phenylcarbamoyl)piperidin-1-yl]sulfonylthiophene-2-carboxylic acid

Systemtic Name: 3-[4-(phenylcarbamoyl)piperidin-1-yl]sulfonylthiophene-2-carboxylic acid Openeye Name: 3-[[4-(phenylcarbamoyl)-1-piperidyl]sulfonyl]thiophene-2-carboxylic acid CAS Name: 3-[[4-[anilino(oxo)methyl]-1-piperidinyl]sulfonyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[4-(phenylcarbamoyl)piperidin-1-yl]sulfonylthiophene-2-carboxylic acid Traditional Name: 3-[4-(phenylcarbamoyl)piperidino]sulfonyl-2-thenoic acid Formula: C17H18N2O5S2 MolecularWeight: 394.46522

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)S(=O)(=O)C3=C(SC=C3)C(=O)O

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)S(=O)(=O)C3=C(SC=C3)C(=O)O

InChI

InChI=1S/C17H18N2O5S2/c20-16(18-13-4-2-1-3-5-13)12-6-9-19(10-7-12)26(23,24)14-8-11-25-15(14)17(21)22/h1-5,8,11-12H,6-7,9-10H2,(H,18,20)(H,21,22)