[(2S)-1-(4-methoxycarbonylpiperidin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-(4-methoxycarbonylpiperidin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-(4-methoxycarbonylpiperidine-1-carbonyl)-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-1-(4-methoxycarbonyl-1-piperidinyl)-4-(methylthio)-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-methoxycarbonylpiperidin-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-(4-carbomethoxypiperidine-1-carbonyl)-3-(methylthio)propyl]ammonium Formula: C12H23N2O3S+ MolecularWeight: 275.38762

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C(CCSC)[NH3+]

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)[C@H](CCSC)[NH3+]

InChI

InChI=1S/C12H22N2O3S/c1-17-12(16)9-3-6-14(7-4-9)11(15)10(13)5-8-18-2/h9-10H,3-8,13H2,1-2H3/p+1/t10-/m0/s1