3-phenyl-3-(1H-pyrazol-4-ylcarbonylamino)propanoic acid

Systemtic Name: 3-phenyl-3-(1H-pyrazol-4-ylcarbonylamino)propanoic acid Openeye Name: 3-phenyl-3-(1H-pyrazole-4-carbonylamino)propanoic acid CAS Name: 3-[[oxo(1H-pyrazol-4-yl)methyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-3-(1H-pyrazole-4-carbonylamino)propanoic acid Traditional Name: 3-phenyl-3-(1H-pyrazole-4-carbonylamino)propionic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CNN=C2

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CNN=C2

InChI

InChI=1S/C13H13N3O3/c17-12(18)6-11(9-4-2-1-3-5-9)16-13(19)10-7-14-15-8-10/h1-5,7-8,11H,6H2,(H,14,15)(H,16,19)(H,17,18)