4-[(1,3-dimethylpyrazol-4-yl)methylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(1,3-dimethylpyrazol-4-yl)methylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[(1,3-dimethylpyrazol-4-yl)methylamino]-4-oxo-butanoate CAS Name: 4-[(1,3-dimethyl-4-pyrazolyl)methylamino]-4-oxobutanoate IUPAC Name: 4-[(1,3-dimethylpyrazol-4-yl)methylamino]-4-oxobutanoate Traditional Name: 4-[(1,3-dimethylpyrazol-4-yl)methylamino]-4-keto-butyrate Formula: C10H14N3O3- MolecularWeight: 224.23646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CNC(=O)CCC(=O)[O-])C

Isomeric SMILES

CC1=NN(C=C1CNC(=O)CCC(=O)[O-])C

InChI

InChI=1S/C10H15N3O3/c1-7-8(6-13(2)12-7)5-11-9(14)3-4-10(15)16/h6H,3-5H2,1-2H3,(H,11,14)(H,15,16)/p-1