3-azanyl-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-4-methoxy-benzamide

Systemtic Name: 3-azanyl-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-4-methoxy-benzamide Openeye Name: 3-amino-4-methoxy-N-[(3R)-quinuclidin-1-ium-3-yl]benzamide CAS Name: 3-amino-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-4-methoxybenzamide IUPAC Name: 3-amino-N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-4-methoxybenzamide Traditional Name: 3-amino-4-methoxy-N-[(3R)-quinuclidin-1-ium-3-yl]benzamide Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2C[NH+]3CCC2CC3)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N[C@H]2C[NH+]3CCC2CC3)N

InChI

InChI=1S/C15H21N3O2/c1-20-14-3-2-11(8-12(14)16)15(19)17-13-9-18-6-4-10(13)5-7-18/h2-3,8,10,13H,4-7,9,16H2,1H3,(H,17,19)/p+1/t13-/m0/s1