(2S)-2-[[(3S)-3-methylpiperidin-1-yl]sulfonylazaniumyl]propanoate

Systemtic Name: (2S)-2-[[(3S)-3-methylpiperidin-1-yl]sulfonylazaniumyl]propanoate Openeye Name: (2S)-2-[[(3S)-3-methyl-1-piperidyl]sulfonylammonio]propanoate CAS Name: (2S)-2-[[(3S)-3-methyl-1-piperidinyl]sulfonylammonio]propanoate IUPAC Name: (2S)-2-[[(3S)-3-methylpiperidin-1-yl]sulfonylazaniumyl]propanoate Traditional Name: (2S)-2-[[(3S)-3-methylpiperidino]sulfonylammonio]propionate Formula: C9H18N2O4S MolecularWeight: 250.31522

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)[NH2+]C(C)C(=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)[NH2+][C@@H](C)C(=O)[O-]

InChI

InChI=1S/C9H18N2O4S/c1-7-4-3-5-11(6-7)16(14,15)10-8(2)9(12)13/h7-8,10H,3-6H2,1-2H3,(H,12,13)/t7-,8-/m0/s1