4-(4-but-2-ynoxyphenyl)sulfonyl-N-oxidanyl-1-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N-oxidanyl-1-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 1-benzyl-4-(4-but-2-ynoxyphenyl)sulfonyl-piperidine-4-carbohydroxamic acid CAS Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-1-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-benzyl-4-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxypiperidine-4-carboxamide Traditional Name: 1-benzyl-4-(4-but-2-ynoxyphenyl)sulfonyl-piperidine-4-carbohydroxamic acid Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C2(CCN(CC2)CC3=CC=CC=C3)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C2(CCN(CC2)CC3=CC=CC=C3)C(=O)NO

InChI

InChI=1S/C23H26N2O5S/c1-2-3-17-30-20-9-11-21(12-10-20)31(28,29)23(22(26)24-27)13-15-25(16-14-23)18-19-7-5-4-6-8-19/h4-12,27H,13-18H2,1H3,(H,24,26)