(2S,3S)-3-methyl-2-(3-pyrazol-1-ylpropanoylamino)pentanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)CCN1C=CC=N1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)CCN1C=CC=N1

InChI

InChI=1S/C12H19N3O3/c1-3-9(2)11(12(17)18)14-10(16)5-8-15-7-4-6-13-15/h4,6-7,9,11H,3,5,8H2,1-2H3,(H,14,16)(H,17,18)/p-1/t9-,11-/m0/s1