3-azanyl-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-methyl-benzamide

Systemtic Name: 3-azanyl-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-methyl-benzamide Openeye Name: 3-amino-2-methyl-N-[(3R)-quinuclidin-1-ium-3-yl]benzamide CAS Name: 3-amino-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-methylbenzamide IUPAC Name: 3-amino-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-2-methylbenzamide Traditional Name: 3-amino-2-methyl-N-[(3R)-quinuclidin-1-ium-3-yl]benzamide Formula: C15H22N3O+ MolecularWeight: 260.35468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N)C(=O)NC2C[NH+]3CCC2CC3

Isomeric SMILES

CC1=C(C=CC=C1N)C(=O)N[C@H]2C[NH+]3CCC2CC3

InChI

InChI=1S/C15H21N3O/c1-10-12(3-2-4-13(10)16)15(19)17-14-9-18-7-5-11(14)6-8-18/h2-4,11,14H,5-9,16H2,1H3,(H,17,19)/p+1/t14-/m0/s1