4-[4-(3,4-dimethylphenoxy)phenyl]sulfonyl-N-oxidanyl-1-prop-2-ynyl-piperidine-4-carboxamide

Systemtic Name: 4-[4-(3,4-dimethylphenoxy)phenyl]sulfonyl-N-oxidanyl-1-prop-2-ynyl-piperidine-4-carboxamide Openeye Name: 4-[4-(3,4-dimethylphenoxy)phenyl]sulfonyl-1-prop-2-ynyl-piperidine-4-carbohydroxamic acid CAS Name: 4-[4-(3,4-dimethylphenoxy)phenyl]sulfonyl-N-hydroxy-1-prop-2-ynyl-4-piperidinecarboxamide IUPAC Name: 4-[4-(3,4-dimethylphenoxy)phenyl]sulfonyl-N-hydroxy-1-prop-2-ynylpiperidine-4-carboxamide Traditional Name: 4-[4-(3,4-dimethylphenoxy)phenyl]sulfonyl-1-propargyl-piperidine-4-carbohydroxamic acid Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)C3(CCN(CC3)CC#C)C(=O)NO)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)C3(CCN(CC3)CC#C)C(=O)NO)C

InChI

InChI=1S/C23H26N2O5S/c1-4-13-25-14-11-23(12-15-25,22(26)24-27)31(28,29)21-9-7-19(8-10-21)30-20-6-5-17(2)18(3)16-20/h1,5-10,16,27H,11-15H2,2-3H3,(H,24,26)