N-butyl-N-[(3R)-1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl]naphthalene-1-carboxamide

Systemtic Name: N-butyl-N-[(3R)-1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl]naphthalene-1-carboxamide Openeye Name: N-butyl-N-[(3R)-1-methylquinuclidin-1-ium-3-yl]naphthalene-1-carboxamide CAS Name: N-butyl-N-[(3R)-1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl]-1-naphthalenecarboxamide IUPAC Name: N-butyl-N-[(3R)-1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl]naphthalene-1-carboxamide Traditional Name: N-butyl-N-[(3R)-1-methylquinuclidin-1-ium-3-yl]-1-naphthamide Formula: C23H31N2O+ MolecularWeight: 351.50504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1C[N+]2(CCC1CC2)C)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCN([C@H]1C[N+]2(CCC1CC2)C)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H31N2O/c1-3-4-14-24(22-17-25(2)15-12-19(22)13-16-25)23(26)21-11-7-9-18-8-5-6-10-20(18)21/h5-11,19,22H,3-4,12-17H2,1-2H3/q+1/t19?,22-,25?/m0/s1