1-azabicyclo[2.2.2]octane; carbamimidoyl-cyano-(4-fluorophenyl)carbonyl-methyl-azanium

Systemtic Name: 1-azabicyclo[2.2.2]octane; carbamimidoyl-cyano-(4-fluorophenyl)carbonyl-methyl-azanium Openeye Name: carbamimidoyl-cyano-(4-fluorobenzoyl)-methyl-ammonium; quinuclidine CAS Name: 1-azabicyclo[2.2.2]octane; carbamimidoyl-cyano-[(4-fluorophenyl)-oxomethyl]-methylammonium IUPAC Name: 1-azabicyclo[2.2.2]octane; carbamimidoyl-cyano-(4-fluorobenzoyl)-methylazanium Traditional Name: amidino-cyano-(4-fluorobenzoyl)-methyl-ammonium; quinuclidine Formula: C17H23FN5O+ MolecularWeight: 332.395823

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C#N)(C(=O)C1=CC=C(C=C1)F)C(=N)N.C1CN2CCC1CC2

Isomeric SMILES

C[N+](C#N)(C(=O)C1=CC=C(C=C1)F)C(=N)N.C1CN2CCC1CC2

InChI

InChI=1S/C10H10FN4O.C7H13N/c1-15(6-12,10(13)14)9(16)7-2-4-8(11)5-3-7;1-4-8-5-2-7(1)3-6-8/h2-5H,1H3,(H3,13,14);7H,1-6H2/q+1;