1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-5-oxo-pyrrolidine-3-carboxylic acid CAS Name: 1-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-5-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: 1-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-5-oxopyrrolidine-3-carboxylic acid Traditional Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-5-keto-pyrrolidine-3-carboxylic acid Formula: C12H17N3O3 MolecularWeight: 251.28168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CN2CC(CC2=O)C(=O)O)C

Isomeric SMILES

CCN1C(=C(C=N1)CN2CC(CC2=O)C(=O)O)C

InChI

InChI=1S/C12H17N3O3/c1-3-15-8(2)10(5-13-15)7-14-6-9(12(17)18)4-11(14)16/h5,9H,3-4,6-7H2,1-2H3,(H,17,18)