4-azanyl-4-oxidanylidene-2-(2-pyrazol-1-ylpropanoylamino)butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-(2-pyrazol-1-ylpropanoylamino)butanoic acid Openeye Name: 4-amino-4-oxo-2-(2-pyrazol-1-ylpropanoylamino)butanoic acid CAS Name: 4-amino-4-oxo-2-[[1-oxo-2-(1-pyrazolyl)propyl]amino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-(2-pyrazol-1-ylpropanoylamino)butanoic acid Traditional Name: 4-amino-4-keto-2-(2-pyrazol-1-ylpropanoylamino)butyric acid Formula: C10H14N4O4 MolecularWeight: 254.24256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)N)C(=O)O)N1C=CC=N1

Isomeric SMILES

CC(C(=O)NC(CC(=O)N)C(=O)O)N1C=CC=N1

InChI

InChI=1S/C10H14N4O4/c1-6(14-4-2-3-12-14)9(16)13-7(10(17)18)5-8(11)15/h2-4,6-7H,5H2,1H3,(H2,11,15)(H,13,16)(H,17,18)