(2S)-2-[(4-methylpiperidin-1-yl)sulfonylazaniumyl]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[(4-methylpiperidin-1-yl)sulfonylazaniumyl]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[(4-methyl-1-piperidyl)sulfonylammonio]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[(4-methyl-1-piperidinyl)sulfonylammonio]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[(4-methylpiperidin-1-yl)sulfonylazaniumyl]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(4-methylpiperidino)sulfonylammonio]-4-(methylthio)butyrate Formula: C11H22N2O4S2 MolecularWeight: 310.43338

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)[NH2+]C(CCSC)C(=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)[NH2+][C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C11H22N2O4S2/c1-9-3-6-13(7-4-9)19(16,17)12-10(11(14)15)5-8-18-2/h9-10,12H,3-8H2,1-2H3,(H,14,15)/t10-/m0/s1