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

Systemtic Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-oxidanyl-1-propan-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-isopropylsulfonyl-piperidine-4-carbohydroxamic acid CAS Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-hydroxy-1-propan-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-N-hydroxy-1-propan-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethyl]-1-isopropylsulfonyl-piperidine-4-carbohydroxamic acid Formula: C20H28N2O7S2 MolecularWeight: 472.57552

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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)C(C)C)C(=O)NO

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O7S2/c1-4-5-14-29-17-6-8-18(9-7-17)30(25,26)15-20(19(23)21-24)10-12-22(13-11-20)31(27,28)16(2)3/h6-9,16,24H,10-15H2,1-3H3,(H,21,23)