N-[1-[2-(4-fluorophenyl)ethyl]pyrrolidin-3-yl]-4-methyl-1-oxidanyl-1-azoniabicyclo[2.2.2]octane-3-carboxamide

Systemtic Name: N-[1-[2-(4-fluorophenyl)ethyl]pyrrolidin-3-yl]-4-methyl-1-oxidanyl-1-azoniabicyclo[2.2.2]octane-3-carboxamide Openeye Name: N-[1-[2-(4-fluorophenyl)ethyl]pyrrolidin-3-yl]-1-hydroxy-4-methyl-quinuclidin-1-ium-3-carboxamide CAS Name: N-[1-[2-(4-fluorophenyl)ethyl]-3-pyrrolidinyl]-1-hydroxy-4-methyl-1-azoniabicyclo[2.2.2]octane-3-carboxamide IUPAC Name: N-[1-[2-(4-fluorophenyl)ethyl]pyrrolidin-3-yl]-1-hydroxy-4-methyl-1-azoniabicyclo[2.2.2]octane-3-carboxamide Traditional Name: N-[1-[2-(4-fluorophenyl)ethyl]pyrrolidin-3-yl]-1-hydroxy-4-methyl-quinuclidin-1-ium-3-carboxamide Formula: C21H31FN3O2+ MolecularWeight: 376.488143

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC[N+](CC1)(CC2C(=O)NC3CCN(C3)CCC4=CC=C(C=C4)F)O

Isomeric SMILES

CC12CC[N+](CC1)(CC2C(=O)NC3CCN(C3)CCC4=CC=C(C=C4)F)O

InChI

InChI=1S/C21H30FN3O2/c1-21-8-12-25(27,13-9-21)15-19(21)20(26)23-18-7-11-24(14-18)10-6-16-2-4-17(22)5-3-16/h2-5,18-19,27H,6-15H2,1H3/p+1