tert-butyl 3-(iodanylmethyl)pyrrolo[2,3-b]pyridine-1-carboxylate

Systemtic Name: tert-butyl 3-(iodanylmethyl)pyrrolo[2,3-b]pyridine-1-carboxylate Openeye Name: tert-butyl 3-(iodomethyl)pyrrolo[2,3-b]pyridine-1-carboxylate CAS Name: 3-(iodomethyl)-1-pyrrolo[2,3-b]pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(iodomethyl)pyrrolo[2,3-b]pyridine-1-carboxylate Traditional Name: 3-(iodomethyl)pyrrolo[2,3-b]pyridine-1-carboxylic acid tert-butyl ester Formula: C13H15IN2O2 MolecularWeight: 358.17487

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1N=CC=C2)CI

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1N=CC=C2)CI

InChI

InChI=1S/C13H15IN2O2/c1-13(2,3)18-12(17)16-8-9(7-14)10-5-4-6-15-11(10)16/h4-6,8H,7H2,1-3H3