(4-tert-butyl-2,6-dimethyl-phenyl)methyl 1H-indazole-3-carboxylate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 1H-indazole-3-carboxylate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2=NNC3=CC=CC=C32)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C2=NNC3=CC=CC=C32)C)C(C)(C)C

InChI

InChI=1S/C21H24N2O2/c1-13-10-15(21(3,4)5)11-14(2)17(13)12-25-20(24)19-16-8-6-7-9-18(16)22-23-19/h6-11H,12H2,1-5H3,(H,22,23)