3-(4-but-2-ynoxyphenyl)-1-methyl-N-oxidanyl-2-sulfinyl-piperidine-4-carboxamide

Systemtic Name: 3-(4-but-2-ynoxyphenyl)-1-methyl-N-oxidanyl-2-sulfinyl-piperidine-4-carboxamide Openeye Name: 3-(4-but-2-ynoxyphenyl)-1-methyl-2-sulfinyl-piperidine-4-carbohydroxamic acid CAS Name: 3-(4-but-2-ynoxyphenyl)-N-hydroxy-1-methyl-2-sulfinyl-4-piperidinecarboxamide IUPAC Name: 3-(4-but-2-ynoxyphenyl)-N-hydroxy-1-methyl-2-sulfinylpiperidine-4-carboxamide Traditional Name: 3-(4-but-2-ynoxyphenyl)-1-methyl-2-sulfinyl-piperidine-4-carbohydroxamic acid Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)C2C(CCN(C2=S=O)C)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)C2C(CCN(C2=S=O)C)C(=O)NO

InChI

InChI=1S/C17H20N2O4S/c1-3-4-11-23-13-7-5-12(6-8-13)15-14(16(20)18-21)9-10-19(2)17(15)24-22/h5-8,14-15,21H,9-11H2,1-2H3,(H,18,20)