4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]sulfonyl-N-oxidanyl-piperidine-4-carboxamide

Systemtic Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]sulfonyl-N-oxidanyl-piperidine-4-carboxamide Openeye Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]sulfonyl-piperidine-4-carbohydroxamic acid CAS Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-hydroxy-1-[[(2R)-2-(hydroxymethyl)-1-pyrrolidinyl]sulfonyl]-4-piperidinecarboxamide IUPAC Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-hydroxy-1-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]sulfonylpiperidine-4-carboxamide Traditional Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-[(2R)-2-methylolpyrrolidino]sulfonyl-piperidine-4-carbohydroxamic acid Formula: C22H31N3O8S2 MolecularWeight: 529.62684

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)CC2(CCN(CC2)S(=O)(=O)N3CCCC3CO)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)CC2(CCN(CC2)S(=O)(=O)N3CCC[C@@H]3CO)C(=O)NO

InChI

InChI=1S/C22H31N3O8S2/c1-2-3-15-33-19-6-8-20(9-7-19)34(29,30)17-22(21(27)23-28)10-13-24(14-11-22)35(31,32)25-12-4-5-18(25)16-26/h6-9,18,26,28H,4-5,10-17H2,1H3,(H,23,27)/t18-/m1/s1