4-[(2-ethyl-5-propan-2-yl-pyrazol-3-yl)carbonylamino]butanoic acid

Systemtic Name: 4-[(2-ethyl-5-propan-2-yl-pyrazol-3-yl)carbonylamino]butanoic acid Openeye Name: 4-[(2-ethyl-5-isopropyl-pyrazole-3-carbonyl)amino]butanoic acid CAS Name: 4-[[(2-ethyl-5-propan-2-yl-3-pyrazolyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(2-ethyl-5-propan-2-ylpyrazole-3-carbonyl)amino]butanoic acid Traditional Name: 4-[(2-ethyl-5-isopropyl-pyrazole-3-carbonyl)amino]butyric acid Formula: C13H21N3O3 MolecularWeight: 267.32414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O3/c1-4-16-11(8-10(15-16)9(2)3)13(19)14-7-5-6-12(17)18/h8-9H,4-7H2,1-3H3,(H,14,19)(H,17,18)