(phenylmethyl) 3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylate

Systemtic Name: (phenylmethyl) 3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylate Openeye Name: benzyl 3-[(tert-butoxycarbonylamino)methyl]-8-azabicyclo[3.2.1]octane-8-carboxylate CAS Name: 3-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylate Traditional Name: 3-[(tert-butoxycarbonylamino)methyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid benzyl ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1CC2CCC(C1)N2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCC1CC2CCC(C1)N2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H30N2O4/c1-21(2,3)27-19(24)22-13-16-11-17-9-10-18(12-16)23(17)20(25)26-14-15-7-5-4-6-8-15/h4-8,16-18H,9-14H2,1-3H3,(H,22,24)