tert-butyl 3-iodanyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylate

Systemtic Name: tert-butyl 3-iodanyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylate Openeye Name: tert-butyl 3-iodo-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylate CAS Name: 3-iodo-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-iodo-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylate Traditional Name: 3-iodo-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylic acid tert-butyl ester Formula: C11H16IN3O2 MolecularWeight: 349.16811

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1)C(=NN2)I

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(C1)C(=NN2)I

InChI

InChI=1S/C11H16IN3O2/c1-11(2,3)17-10(16)15-5-4-8-7(6-15)9(12)14-13-8/h4-6H2,1-3H3,(H,13,14)