(3,3-dimethyl-2-oxidanylidene-butyl) 1H-indazole-3-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 1H-indazole-3-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C14H16N2O3 MolecularWeight: 260.28844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=NNC2=CC=CC=C21

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=NNC2=CC=CC=C21

InChI

InChI=1S/C14H16N2O3/c1-14(2,3)11(17)8-19-13(18)12-9-6-4-5-7-10(9)15-16-12/h4-7H,8H2,1-3H3,(H,15,16)