(2S)-4-azanyl-2-[[(3S)-3-methylpiperidin-1-yl]sulfonylazaniumyl]-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-azanyl-2-[[(3S)-3-methylpiperidin-1-yl]sulfonylazaniumyl]-4-oxidanylidene-butanoate Openeye Name: (2S)-4-amino-2-[[(3S)-3-methyl-1-piperidyl]sulfonylammonio]-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[(3S)-3-methyl-1-piperidinyl]sulfonylammonio]-4-oxobutanoate IUPAC Name: (2S)-4-amino-2-[[(3S)-3-methylpiperidin-1-yl]sulfonylazaniumyl]-4-oxobutanoate Traditional Name: (2S)-4-amino-4-keto-2-[[(3S)-3-methylpiperidino]sulfonylammonio]butyrate Formula: C10H19N3O5S MolecularWeight: 293.33996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H19N3O5S/c1-7-3-2-4-13(6-7)19(17,18)12-8(10(15)16)5-9(11)14/h7-8,12H,2-6H2,1H3,(H2,11,14)(H,15,16)/t7-,8-/m0/s1