1-[(4-bromophenyl)methyl]-N-oxidanyl-4-(4-prop-2-ynoxyphenyl)sulfonyl-piperidine-4-carboxamide hydrochloride

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-oxidanyl-4-(4-prop-2-ynoxyphenyl)sulfonyl-piperidine-4-carboxamide hydrochloride Openeye Name: 1-[(4-bromophenyl)methyl]-4-(4-prop-2-ynoxyphenyl)sulfonyl-piperidine-4-carbohydroxamic acid hydrochloride CAS Name: 1-[(4-bromophenyl)methyl]-N-hydroxy-4-(4-prop-2-ynoxyphenyl)sulfonyl-4-piperidinecarboxamide hydrochloride IUPAC Name: 1-[(4-bromophenyl)methyl]-N-hydroxy-4-(4-prop-2-ynoxyphenyl)sulfonylpiperidine-4-carboxamide hydrochloride Traditional Name: 1-(4-bromobenzyl)-4-(4-propargyloxyphenyl)sulfonyl-piperidine-4-carbohydroxamic acid hydrochloride Formula: C22H24BrClN2O5S MolecularWeight: 543.85836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23BrN2O5S.ClH/c1-2-15-30-19-7-9-20(10-8-19)31(28,29)22(21(26)24-27)11-13-25(14-12-22)16-17-3-5-18(23)6-4-17;/h1,3-10,27H,11-16H2,(H,24,26);1H