4-[4-piperidin-1-ylsulfonyl-2-(thiophen-3-ylcarbonylamino)phenoxy]benzoic acid

Systemtic Name: 4-[4-piperidin-1-ylsulfonyl-2-(thiophen-3-ylcarbonylamino)phenoxy]benzoic acid Openeye Name: 4-[4-(1-piperidylsulfonyl)-2-(thiophene-3-carbonylamino)phenoxy]benzoic acid CAS Name: 4-[2-[[oxo(3-thiophenyl)methyl]amino]-4-(1-piperidinylsulfonyl)phenoxy]benzoic acid IUPAC Name: 4-[4-piperidin-1-ylsulfonyl-2-(thiophene-3-carbonylamino)phenoxy]benzoic acid Traditional Name: 4-[4-piperidinosulfonyl-2-(3-thenoylamino)phenoxy]benzoic acid Formula: C23H22N2O6S2 MolecularWeight: 486.56058

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)C(=O)O)NC(=O)C4=CSC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)C(=O)O)NC(=O)C4=CSC=C4

InChI

InChI=1S/C23H22N2O6S2/c26-22(17-10-13-32-15-17)24-20-14-19(33(29,30)25-11-2-1-3-12-25)8-9-21(20)31-18-6-4-16(5-7-18)23(27)28/h4-10,13-15H,1-3,11-12H2,(H,24,26)(H,27,28)