(2S)-4-methyl-2-[[(3R)-3-methylpiperidin-1-yl]sulfonylazaniumyl]pentanoate

Systemtic Name: (2S)-4-methyl-2-[[(3R)-3-methylpiperidin-1-yl]sulfonylazaniumyl]pentanoate Openeye Name: (2S)-4-methyl-2-[[(3R)-3-methyl-1-piperidyl]sulfonylammonio]pentanoate CAS Name: (2S)-4-methyl-2-[[(3R)-3-methyl-1-piperidinyl]sulfonylammonio]pentanoate IUPAC Name: (2S)-4-methyl-2-[[(3R)-3-methylpiperidin-1-yl]sulfonylazaniumyl]pentanoate Traditional Name: (2S)-4-methyl-2-[[(3R)-3-methylpiperidino]sulfonylammonio]valerate Formula: C12H24N2O4S MolecularWeight: 292.39496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H24N2O4S/c1-9(2)7-11(12(15)16)13-19(17,18)14-6-4-5-10(3)8-14/h9-11,13H,4-8H2,1-3H3,(H,15,16)/t10-,11+/m1/s1