4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-oxidanyl-1-pyrrolidin-1-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-oxidanyl-1-pyrrolidin-1-ylsulfonyl-piperidine-4-carboxamide Openeye Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-pyrrolidin-1-ylsulfonyl-piperidine-4-carbohydroxamic acid CAS Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-hydroxy-1-(1-pyrrolidinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-hydroxy-1-pyrrolidin-1-ylsulfonylpiperidine-4-carboxamide Traditional Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-pyrrolidinosulfonyl-piperidine-4-carbohydroxamic acid Formula: C21H29N3O7S2 MolecularWeight: 499.60086

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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)N3CCCC3)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)CC2(CCN(CC2)S(=O)(=O)N3CCCC3)C(=O)NO

InChI

InChI=1S/C21H29N3O7S2/c1-2-3-16-31-18-6-8-19(9-7-18)32(27,28)17-21(20(25)22-26)10-14-24(15-11-21)33(29,30)23-12-4-5-13-23/h6-9,26H,4-5,10-17H2,1H3,(H,22,25)