3,3-dimethyl-2-(3-pyrazol-1-ylpropanoylamino)butanoic acid

Systemtic Name: 3,3-dimethyl-2-(3-pyrazol-1-ylpropanoylamino)butanoic acid Openeye Name: 3,3-dimethyl-2-(3-pyrazol-1-ylpropanoylamino)butanoic acid CAS Name: 3,3-dimethyl-2-[[1-oxo-3-(1-pyrazolyl)propyl]amino]butanoic acid IUPAC Name: 3,3-dimethyl-2-(3-pyrazol-1-ylpropanoylamino)butanoic acid Traditional Name: 3,3-dimethyl-2-(3-pyrazol-1-ylpropanoylamino)butyric acid Formula: C12H19N3O3 MolecularWeight: 253.29756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)NC(=O)CCN1C=CC=N1

Isomeric SMILES

CC(C)(C)C(C(=O)O)NC(=O)CCN1C=CC=N1

InChI

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