(2S,3S)-3-methyl-2-[[(2R)-2-pyrazol-1-ylpropanoyl]amino]pentanoate

Systemtic Name: (2S,3S)-3-methyl-2-[[(2R)-2-pyrazol-1-ylpropanoyl]amino]pentanoate Openeye Name: (2S,3S)-3-methyl-2-[[(2R)-2-pyrazol-1-ylpropanoyl]amino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[[(2R)-1-oxo-2-(1-pyrazolyl)propyl]amino]pentanoate IUPAC Name: (2S,3S)-3-methyl-2-[[(2R)-2-pyrazol-1-ylpropanoyl]amino]pentanoate Traditional Name: (2S,3S)-3-methyl-2-[[(2R)-2-pyrazol-1-ylpropanoyl]amino]valerate Formula: C12H18N3O3- MolecularWeight: 252.28962

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)C(C)N1C=CC=N1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)[C@@H](C)N1C=CC=N1

InChI

InChI=1S/C12H19N3O3/c1-4-8(2)10(12(17)18)14-11(16)9(3)15-7-5-6-13-15/h5-10H,4H2,1-3H3,(H,14,16)(H,17,18)/p-1/t8-,9+,10-/m0/s1