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

Systemtic Name: 4-[2-(furan-2-ylcarbonylamino)-4-piperidin-1-ylsulfonyl-phenoxy]benzoic acid Openeye Name: 4-[2-(furan-2-carbonylamino)-4-(1-piperidylsulfonyl)phenoxy]benzoic acid CAS Name: 4-[2-[[2-furanyl(oxo)methyl]amino]-4-(1-piperidinylsulfonyl)phenoxy]benzoic acid IUPAC Name: 4-[2-(furan-2-carbonylamino)-4-piperidin-1-ylsulfonylphenoxy]benzoic acid Traditional Name: 4-[2-(2-furoylamino)-4-piperidinosulfonyl-phenoxy]benzoic acid Formula: C23H22N2O7S MolecularWeight: 470.49498

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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=CC=CO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)C(=O)O)NC(=O)C4=CC=CO4

InChI

InChI=1S/C23H22N2O7S/c26-22(21-5-4-14-31-21)24-19-15-18(33(29,30)25-12-2-1-3-13-25)10-11-20(19)32-17-8-6-16(7-9-17)23(27)28/h4-11,14-15H,1-3,12-13H2,(H,24,26)(H,27,28)