2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethanoylamino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethanoylamino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-oxoethyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]-3,3-dimethylbutanoic acid Traditional Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]-3,3-dimethyl-butyric acid Formula: C13H21N3O3 MolecularWeight: 267.32414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CC(=O)NC(C(=O)O)C(C)(C)C

Isomeric SMILES

CC1=C(C(=NN1)C)CC(=O)NC(C(=O)O)C(C)(C)C

InChI

InChI=1S/C13H21N3O3/c1-7-9(8(2)16-15-7)6-10(17)14-11(12(18)19)13(3,4)5/h11H,6H2,1-5H3,(H,14,17)(H,15,16)(H,18,19)