tert-butyl 4-chloranylpyrrolo[2,3-b]pyridine-1-carboxylate

Systemtic Name: tert-butyl 4-chloranylpyrrolo[2,3-b]pyridine-1-carboxylate Openeye Name: tert-butyl 4-chloropyrrolo[2,3-b]pyridine-1-carboxylate CAS Name: 4-chloro-1-pyrrolo[2,3-b]pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-chloropyrrolo[2,3-b]pyridine-1-carboxylate Traditional Name: 4-chloropyrrolo[2,3-b]pyridine-1-carboxylic acid tert-butyl ester Formula: C12H13ClN2O2 MolecularWeight: 252.69682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC2=C(C=CN=C21)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC2=C(C=CN=C21)Cl

InChI

InChI=1S/C12H13ClN2O2/c1-12(2,3)17-11(16)15-7-5-8-9(13)4-6-14-10(8)15/h4-7H,1-3H3