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

Systemtic Name: 2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]-3-methyl-butyric acid Formula: C12H19N3O3 MolecularWeight: 253.29756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N3O3/c1-6(2)11(12(17)18)13-10(16)5-9-7(3)14-15-8(9)4/h6,11H,5H2,1-4H3,(H,13,16)(H,14,15)(H,17,18)