(phenylmethyl) 5-[(phenylmethyl)amino]-3-azabicyclo[2.2.2]octane-3-carboxylate

Systemtic Name: (phenylmethyl) 5-[(phenylmethyl)amino]-3-azabicyclo[2.2.2]octane-3-carboxylate Openeye Name: benzyl 5-(benzylamino)-3-azabicyclo[2.2.2]octane-3-carboxylate CAS Name: 5-[(phenylmethyl)amino]-3-azabicyclo[2.2.2]octane-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(benzylamino)-3-azabicyclo[2.2.2]octane-3-carboxylate Traditional Name: 5-(benzylamino)-3-azabicyclo[2.2.2]octane-3-carboxylic acid benzyl ester Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(CC1CN2C(=O)OCC3=CC=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

C1CC2C(CC1CN2C(=O)OCC3=CC=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C22H26N2O2/c25-22(26-16-18-9-5-2-6-10-18)24-15-19-11-12-21(24)20(13-19)23-14-17-7-3-1-4-8-17/h1-10,19-21,23H,11-16H2