3-[butanoyl(methylsulfanyl)amino]oxycarbonylpiperidine-1-carboxylate

Systemtic Name: 3-[butanoyl(methylsulfanyl)amino]oxycarbonylpiperidine-1-carboxylate Openeye Name: 3-[butanoyl(methylsulfanyl)amino]oxycarbonylpiperidine-1-carboxylate CAS Name: 3-[[(methylthio)-(1-oxobutyl)amino]oxy-oxomethyl]-1-piperidinecarboxylate IUPAC Name: 3-[butanoyl(methylsulfanyl)amino]oxycarbonylpiperidine-1-carboxylate Traditional Name: 3-[butyryl-(methylthio)amino]oxycarbonylpiperidine-1-carboxylate Formula: C12H19N2O5S- MolecularWeight: 303.35466

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(OC(=O)C1CCCN(C1)C(=O)[O-])SC

Isomeric SMILES

CCCC(=O)N(OC(=O)C1CCCN(C1)C(=O)[O-])SC

InChI

InChI=1S/C12H20N2O5S/c1-3-5-10(15)14(20-2)19-11(16)9-6-4-7-13(8-9)12(17)18/h9H,3-8H2,1-2H3,(H,17,18)/p-1