methyl 3-azanyl-1,2-ditert-butyl-5-oxidanylidene-pyrazole-4-carboxylate

Systemtic Name: methyl 3-azanyl-1,2-ditert-butyl-5-oxidanylidene-pyrazole-4-carboxylate Openeye Name: methyl 3-amino-1,2-ditert-butyl-5-oxo-pyrazole-4-carboxylate CAS Name: 3-amino-1,2-ditert-butyl-5-oxo-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-1,2-ditert-butyl-5-oxopyrazole-4-carboxylate Traditional Name: 3-amino-1,2-ditert-butyl-5-keto-3-pyrazoline-4-carboxylic acid methyl ester Formula: C13H23N3O3 MolecularWeight: 269.34002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=C(C(=O)N1C(C)(C)C)C(=O)OC)N

Isomeric SMILES

CC(C)(C)N1C(=C(C(=O)N1C(C)(C)C)C(=O)OC)N

InChI

InChI=1S/C13H23N3O3/c1-12(2,3)15-9(14)8(11(18)19-7)10(17)16(15)13(4,5)6/h14H2,1-7H3