3-[[(2-methylpropan-2-yl)oxycarbonyl-pyridin-4-yl-amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid

Systemtic Name: 3-[[(2-methylpropan-2-yl)oxycarbonyl-pyridin-4-yl-amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid Openeye Name: 3-[[tert-butoxycarbonyl(4-pyridyl)amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid CAS Name: 3-[[[(2-methylpropan-2-yl)oxy-oxomethyl]-pyridin-4-ylamino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid IUPAC Name: 3-[[(2-methylpropan-2-yl)oxycarbonyl-pyridin-4-ylamino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid Traditional Name: 3-[[tert-butoxycarbonyl(4-pyridyl)amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid Formula: C19H27N3O4 MolecularWeight: 361.43538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1CC2CCC(C1)N2C(=O)O)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1CC2CCC(C1)N2C(=O)O)C3=CC=NC=C3

InChI

InChI=1S/C19H27N3O4/c1-19(2,3)26-18(25)21(14-6-8-20-9-7-14)12-13-10-15-4-5-16(11-13)22(15)17(23)24/h6-9,13,15-16H,4-5,10-12H2,1-3H3,(H,23,24)