(2S)-2-[[(2R)-2-ethylpiperidin-1-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[[(2R)-2-ethylpiperidin-1-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[(2R)-2-ethylpiperidine-1-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[[(2R)-2-ethyl-1-piperidinyl]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[(2R)-2-ethylpiperidine-1-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[(2R)-2-ethylpiperidine-1-carbonyl]amino]-4-(methylthio)butyrate Formula: C13H23N2O3S- MolecularWeight: 287.39832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC[C@@H]1CCCCN1C(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C13H24N2O3S/c1-3-10-6-4-5-8-15(10)13(18)14-11(12(16)17)7-9-19-2/h10-11H,3-9H2,1-2H3,(H,14,18)(H,16,17)/p-1/t10-,11+/m1/s1