1-azabicyclo[2.2.2]octan-3-yl N-[(4-cyanophenyl)methyl]-N-phenyl-carbamate

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl N-[(4-cyanophenyl)methyl]-N-phenyl-carbamate Openeye Name: quinuclidin-3-yl N-[(4-cyanophenyl)methyl]-N-phenyl-carbamate CAS Name: N-[(4-cyanophenyl)methyl]-N-phenylcarbamic acid 1-azabicyclo[2.2.2]octan-3-yl ester IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl N-[(4-cyanophenyl)methyl]-N-phenylcarbamate Traditional Name: N-(4-cyanobenzyl)-N-phenyl-carbamic acid quinuclidin-3-yl ester Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)OC(=O)N(CC3=CC=C(C=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

C1CN2CCC1C(C2)OC(=O)N(CC3=CC=C(C=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2/c23-14-17-6-8-18(9-7-17)15-25(20-4-2-1-3-5-20)22(26)27-21-16-24-12-10-19(21)11-13-24/h1-9,19,21H,10-13,15-16H2