4-[[4-(furan-2-ylmethylsulfamoyl)phenyl]amino]-4-oxidanylidene-2-piperidin-1-yl-butanoic acid

Systemtic Name: 4-[[4-(furan-2-ylmethylsulfamoyl)phenyl]amino]-4-oxidanylidene-2-piperidin-1-yl-butanoic acid Openeye Name: 4-[4-(2-furylmethylsulfamoyl)anilino]-4-oxo-2-(1-piperidyl)butanoic acid CAS Name: 4-[4-(2-furanylmethylsulfamoyl)anilino]-4-oxo-2-(1-piperidinyl)butanoic acid IUPAC Name: 4-[4-(furan-2-ylmethylsulfamoyl)anilino]-4-oxo-2-piperidin-1-ylbutanoic acid Traditional Name: 4-[4-(2-furfurylsulfamoyl)anilino]-4-keto-2-piperidino-butyric acid Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3)C(=O)O

Isomeric SMILES

C1CCN(CC1)C(CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3)C(=O)O

InChI

InChI=1S/C20H25N3O6S/c24-19(13-18(20(25)26)23-10-2-1-3-11-23)22-15-6-8-17(9-7-15)30(27,28)21-14-16-5-4-12-29-16/h4-9,12,18,21H,1-3,10-11,13-14H2,(H,22,24)(H,25,26)