tert-butyl (2S,3R)-3-oxidanyl-2-(1H-pyrrolo[2,3-b]pyridin-6-ylamino)butanoate

Systemtic Name: tert-butyl (2S,3R)-3-oxidanyl-2-(1H-pyrrolo[2,3-b]pyridin-6-ylamino)butanoate Openeye Name: tert-butyl (2S,3R)-3-hydroxy-2-(1H-pyrrolo[2,3-b]pyridin-6-ylamino)butanoate CAS Name: (2S,3R)-3-hydroxy-2-(1H-pyrrolo[2,3-b]pyridin-6-ylamino)butanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-3-hydroxy-2-(1H-pyrrolo[2,3-b]pyridin-6-ylamino)butanoate Traditional Name: (2S,3R)-3-hydroxy-2-(1H-pyrrolo[2,3-b]pyridin-6-ylamino)butyric acid tert-butyl ester Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC(C)(C)C)NC1=NC2=C(C=C1)C=CN2)O

Isomeric SMILES

C[C@H]([C@@H](C(=O)OC(C)(C)C)NC1=NC2=C(C=C1)C=CN2)O

InChI

InChI=1S/C15H21N3O3/c1-9(19)12(14(20)21-15(2,3)4)17-11-6-5-10-7-8-16-13(10)18-11/h5-9,12,19H,1-4H3,(H2,16,17,18)/t9-,12+/m1/s1