2-[[1-[(2S)-2-azaniumyl-3-methyl-butanoyl]piperidin-4-yl]carbonylamino]ethanoate

Systemtic Name: 2-[[1-[(2S)-2-azaniumyl-3-methyl-butanoyl]piperidin-4-yl]carbonylamino]ethanoate Openeye Name: 2-[[1-[(2S)-2-azaniumyl-3-methyl-butanoyl]piperidine-4-carbonyl]amino]acetate CAS Name: 2-[[[1-[(2S)-2-ammonio-3-methyl-1-oxobutyl]-4-piperidinyl]-oxomethyl]amino]acetate IUPAC Name: 2-[[1-[(2S)-2-azaniumyl-3-methylbutanoyl]piperidine-4-carbonyl]amino]acetate Traditional Name: 2-[[1-[(2S)-2-ammonio-3-methyl-butanoyl]isonipecotoyl]amino]acetate Formula: C13H23N3O4 MolecularWeight: 285.33942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)C(=O)NCC(=O)[O-])[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC(CC1)C(=O)NCC(=O)[O-])[NH3+]

InChI

InChI=1S/C13H23N3O4/c1-8(2)11(14)13(20)16-5-3-9(4-6-16)12(19)15-7-10(17)18/h8-9,11H,3-7,14H2,1-2H3,(H,15,19)(H,17,18)/t11-/m0/s1