but-2-ynoxybenzene; 2-(1-ethanoylpiperidin-4-yl)-N-oxidanyl-2-sulfonyl-ethanamide

Systemtic Name: but-2-ynoxybenzene; 2-(1-ethanoylpiperidin-4-yl)-N-oxidanyl-2-sulfonyl-ethanamide Openeye Name: 2-(1-acetyl-4-piperidyl)-2-sulfonyl-ethanehydroxamic acid; but-2-ynoxybenzene CAS Name: 2-(1-acetyl-4-piperidinyl)-N-hydroxy-2-sulfonylacetamide; but-2-ynoxybenzene IUPAC Name: 2-(1-acetylpiperidin-4-yl)-N-hydroxy-2-sulfonylacetamide; but-2-ynoxybenzene Traditional Name: 2-(1-acetyl-4-piperidyl)-2-sulfonyl-ethanehydroxamic acid; but-2-ynoxybenzene Formula: C19H24N2O6S MolecularWeight: 408.46866

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=CC=C1.CC(=O)N1CCC(CC1)C(=S(=O)=O)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=CC=C1.CC(=O)N1CCC(CC1)C(=S(=O)=O)C(=O)NO

InChI

InChI=1S/C10H10O.C9H14N2O5S/c1-2-3-9-11-10-7-5-4-6-8-10;1-6(12)11-4-2-7(3-5-11)8(17(15)16)9(13)10-14/h4-8H,9H2,1H3;7,14H,2-5H2,1H3,(H,10,13)