tert-butyl 9-(5-ethoxypyridin-3-yl)-4,9-diazabicyclo[4.2.1]nonane-4-carboxylate

Systemtic Name: tert-butyl 9-(5-ethoxypyridin-3-yl)-4,9-diazabicyclo[4.2.1]nonane-4-carboxylate Openeye Name: tert-butyl 9-(5-ethoxy-3-pyridyl)-4,9-diazabicyclo[4.2.1]nonane-4-carboxylate CAS Name: 9-(5-ethoxy-3-pyridinyl)-4,9-diazabicyclo[4.2.1]nonane-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 9-(5-ethoxypyridin-3-yl)-4,9-diazabicyclo[4.2.1]nonane-4-carboxylate Traditional Name: 9-(5-ethoxy-3-pyridyl)-4,9-diazabicyclo[4.2.1]nonane-4-carboxylic acid tert-butyl ester Formula: C19H29N3O3 MolecularWeight: 347.45186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN=CC(=C1)N2C3CCC2CN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CN=CC(=C1)N2C3CCC2CN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H29N3O3/c1-5-24-17-10-16(11-20-12-17)22-14-6-7-15(22)13-21(9-8-14)18(23)25-19(2,3)4/h10-12,14-15H,5-9,13H2,1-4H3