1-azabicyclo[2.2.2]octan-3-yl N-[2-(naphthalen-1-ylmethylsulfanyl)phenyl]carbamate

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl N-[2-(naphthalen-1-ylmethylsulfanyl)phenyl]carbamate Openeye Name: quinuclidin-3-yl N-[2-(1-naphthylmethylsulfanyl)phenyl]carbamate CAS Name: N-[2-(1-naphthalenylmethylthio)phenyl]carbamic acid 1-azabicyclo[2.2.2]octan-3-yl ester IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl N-[2-(naphthalen-1-ylmethylsulfanyl)phenyl]carbamate Traditional Name: N-[2-(1-naphthylmethylthio)phenyl]carbamic acid quinuclidin-3-yl ester Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)OC(=O)NC3=CC=CC=C3SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN2CCC1C(C2)OC(=O)NC3=CC=CC=C3SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H26N2O2S/c28-25(29-23-16-27-14-12-19(23)13-15-27)26-22-10-3-4-11-24(22)30-17-20-8-5-7-18-6-1-2-9-21(18)20/h1-11,19,23H,12-17H2,(H,26,28)