N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-4-methyl-3-oxidanyl-benzamide

Systemtic Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-4-methyl-3-oxidanyl-benzamide Openeye Name: 3-hydroxy-4-methyl-N-[(3R)-quinuclidin-1-ium-3-yl]benzamide CAS Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-3-hydroxy-4-methylbenzamide IUPAC Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-3-hydroxy-4-methylbenzamide Traditional Name: 3-hydroxy-4-methyl-N-[(3R)-quinuclidin-1-ium-3-yl]benzamide Formula: C15H21N2O2+ MolecularWeight: 261.33944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2C[NH+]3CCC2CC3)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N[C@H]2C[NH+]3CCC2CC3)O

InChI

InChI=1S/C15H20N2O2/c1-10-2-3-12(8-14(10)18)15(19)16-13-9-17-6-4-11(13)5-7-17/h2-3,8,11,13,18H,4-7,9H2,1H3,(H,16,19)/p+1/t13-/m0/s1