methyl 3,5-dimethyl-5-oxidanyl-4H-pyrazole-1-carboxylate

Systemtic Name: methyl 3,5-dimethyl-5-oxidanyl-4H-pyrazole-1-carboxylate Openeye Name: methyl 5-hydroxy-3,5-dimethyl-4H-pyrazole-1-carboxylate CAS Name: 5-hydroxy-3,5-dimethyl-4H-pyrazole-1-carboxylic acid methyl ester IUPAC Name: methyl 5-hydroxy-3,5-dimethyl-4H-pyrazole-1-carboxylate Traditional Name: 5-hydroxy-3,5-dimethyl-2-pyrazoline-1-carboxylic acid methyl ester Formula: C7H12N2O3 MolecularWeight: 172.18178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C)O)C(=O)OC

Isomeric SMILES

CC1=NN(C(C1)(C)O)C(=O)OC

InChI

InChI=1S/C7H12N2O3/c1-5-4-7(2,11)9(8-5)6(10)12-3/h11H,4H2,1-3H3