2-[3-(1,3,5-trimethylpyrazol-4-yl)propanoylamino]butanoic acid

Systemtic Name: 2-[3-(1,3,5-trimethylpyrazol-4-yl)propanoylamino]butanoic acid Openeye Name: 2-[3-(1,3,5-trimethylpyrazol-4-yl)propanoylamino]butanoic acid CAS Name: 2-[[1-oxo-3-(1,3,5-trimethyl-4-pyrazolyl)propyl]amino]butanoic acid IUPAC Name: 2-[3-(1,3,5-trimethylpyrazol-4-yl)propanoylamino]butanoic acid Traditional Name: 2-[3-(1,3,5-trimethylpyrazol-4-yl)propanoylamino]butyric acid Formula: C13H21N3O3 MolecularWeight: 267.32414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)CCC1=C(N(N=C1C)C)C

Isomeric SMILES

CCC(C(=O)O)NC(=O)CCC1=C(N(N=C1C)C)C

InChI

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