4-[(4-bromophenyl)methyl]-1-(4-but-2-ynoxyphenyl)sulfonyl-N-oxidanyl-piperazine-2-carboxamide

Systemtic Name: 4-[(4-bromophenyl)methyl]-1-(4-but-2-ynoxyphenyl)sulfonyl-N-oxidanyl-piperazine-2-carboxamide Openeye Name: 4-[(4-bromophenyl)methyl]-1-(4-but-2-ynoxyphenyl)sulfonyl-piperazine-2-carbohydroxamic acid CAS Name: 4-[(4-bromophenyl)methyl]-1-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-2-piperazinecarboxamide IUPAC Name: 4-[(4-bromophenyl)methyl]-1-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxypiperazine-2-carboxamide Traditional Name: 4-(4-bromobenzyl)-1-(4-but-2-ynoxyphenyl)sulfonyl-piperazine-2-carbohydroxamic acid Formula: C22H24BrN3O5S MolecularWeight: 522.41206

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)NO)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)NO)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H24BrN3O5S/c1-2-3-14-31-19-8-10-20(11-9-19)32(29,30)26-13-12-25(16-21(26)22(27)24-28)15-17-4-6-18(23)7-5-17/h4-11,21,28H,12-16H2,1H3,(H,24,27)