(5S,6S)-7-methylsulfonyl-N-oxidanyl-6-(4-phenylpiperazin-1-yl)carbonyl-7-azaspiro[2.5]octane-5-carboxamide

Systemtic Name: (5S,6S)-7-methylsulfonyl-N-oxidanyl-6-(4-phenylpiperazin-1-yl)carbonyl-7-azaspiro[2.5]octane-5-carboxamide Openeye Name: (5S,6S)-7-methylsulfonyl-6-(4-phenylpiperazine-1-carbonyl)-7-azaspiro[2.5]octane-5-carbohydroxamic acid CAS Name: (5S,6S)-N-hydroxy-7-methylsulfonyl-6-[oxo-(4-phenyl-1-piperazinyl)methyl]-7-azaspiro[2.5]octane-5-carboxamide IUPAC Name: (5S,6S)-N-hydroxy-7-methylsulfonyl-6-(4-phenylpiperazine-1-carbonyl)-7-azaspiro[2.5]octane-5-carboxamide Traditional Name: (5S,6S)-7-mesyl-6-(4-phenylpiperazine-1-carbonyl)-7-azaspiro[2.5]octane-5-carbohydroxamic acid Formula: C20H28N4O5S MolecularWeight: 436.52512

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2(CC2)CC(C1C(=O)N3CCN(CC3)C4=CC=CC=C4)C(=O)NO

Isomeric SMILES

CS(=O)(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N3CCN(CC3)C4=CC=CC=C4)C(=O)NO

InChI

InChI=1S/C20H28N4O5S/c1-30(28,29)24-14-20(7-8-20)13-16(18(25)21-27)17(24)19(26)23-11-9-22(10-12-23)15-5-3-2-4-6-15/h2-6,16-17,27H,7-14H2,1H3,(H,21,25)/t16-,17-/m0/s1