[(2S,5R)-7-oxidanylidene-2-(piperidin-2-ylmethylcarbamoyl)-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate

Systemtic Name: [(2S,5R)-7-oxidanylidene-2-(piperidin-2-ylmethylcarbamoyl)-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate Openeye Name: [(2S,5R)-7-oxo-2-(2-piperidylmethylcarbamoyl)-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate CAS Name: sulfuric acid [(2S,5R)-7-oxo-2-[oxo-(2-piperidinylmethylamino)methyl]-1,6-diazabicyclo[3.2.1]octan-6-yl] ester IUPAC Name: [(2S,5R)-7-oxo-2-(piperidin-2-ylmethylcarbamoyl)-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate Traditional Name: sulfuric acid [(2S,5R)-7-keto-2-(2-piperidylmethylcarbamoyl)-1,6-diazabicyclo[3.2.1]octan-6-yl] ester Formula: C13H22N4O6S MolecularWeight: 362.40198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)CNC(=O)C2CCC3CN2C(=O)N3OS(=O)(=O)O

Isomeric SMILES

C1CCNC(C1)CNC(=O)[C@@H]2CC[C@@H]3CN2C(=O)N3OS(=O)(=O)O

InChI

InChI=1S/C13H22N4O6S/c18-12(15-7-9-3-1-2-6-14-9)11-5-4-10-8-16(11)13(19)17(10)23-24(20,21)22/h9-11,14H,1-8H2,(H,15,18)(H,20,21,22)/t9?,10-,11+/m1/s1