3-piperidin-1-ylcarbothioylsulfanylpropane-1-sulfonate

Systemtic Name: 3-piperidin-1-ylcarbothioylsulfanylpropane-1-sulfonate Openeye Name: 3-(piperidine-1-carbothioylsulfanyl)propane-1-sulfonate CAS Name: 3-[[1-piperidinyl(sulfanylidene)methyl]thio]-1-propanesulfonate IUPAC Name: 3-(piperidine-1-carbothioylsulfanyl)propane-1-sulfonate Traditional Name: 3-(piperidine-1-carbothioylthio)propane-1-sulfonate Formula: C9H16NO3S3- MolecularWeight: 282.42324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)SCCCS(=O)(=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=S)SCCCS(=O)(=O)[O-]

InChI

InChI=1S/C9H17NO3S3/c11-16(12,13)8-4-7-15-9(14)10-5-2-1-3-6-10/h1-8H2,(H,11,12,13)/p-1