tert-butyl [4-(1H-pyrrolo[2,3-b]pyridin-3-yl)piperidin-1-yl] carbonate

Systemtic Name: tert-butyl [4-(1H-pyrrolo[2,3-b]pyridin-3-yl)piperidin-1-yl] carbonate Openeye Name: tert-butyl [4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-1-piperidyl] carbonate CAS Name: carbonic acid tert-butyl [4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-1-piperidinyl] ester IUPAC Name: tert-butyl [4-(1H-pyrrolo[2,3-b]pyridin-3-yl)piperidin-1-yl] carbonate Traditional Name: carbonic acid tert-butyl [4-(1H-pyrrolo[2,3-b]pyridin-3-yl)piperidino] ester Formula: C17H23N3O3 MolecularWeight: 317.38282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)ON1CCC(CC1)C2=CNC3=C2C=CC=N3

Isomeric SMILES

CC(C)(C)OC(=O)ON1CCC(CC1)C2=CNC3=C2C=CC=N3

InChI

InChI=1S/C17H23N3O3/c1-17(2,3)22-16(21)23-20-9-6-12(7-10-20)14-11-19-15-13(14)5-4-8-18-15/h4-5,8,11-12H,6-7,9-10H2,1-3H3,(H,18,19)