N-(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonyl-1-azabicyclo[2.2.2]octan-3-amine oxide

Systemtic Name: N-(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonyl-1-azabicyclo[2.2.2]octan-3-amine oxide Openeye Name: N-(4-amino-5-chloro-2-methoxy-benzoyl)quinuclidin-3-amine oxide CAS Name: N-[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]-1-azabicyclo[2.2.2]octan-3-amine oxide IUPAC Name: N-(4-amino-5-chloro-2-methoxybenzoyl)-1-azabicyclo[2.2.2]octan-3-amine oxide Traditional Name: N-(4-amino-5-chloro-2-methoxy-benzoyl)quinuclidin-3-amine oxide Formula: C15H20ClN3O3 MolecularWeight: 325.7906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)[NH+](C2CN3CCC2CC3)[O-])Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)[NH+](C2CN3CCC2CC3)[O-])Cl)N

InChI

InChI=1S/C15H20ClN3O3/c1-22-14-7-12(17)11(16)6-10(14)15(20)19(21)13-8-18-4-2-9(13)3-5-18/h6-7,9,13,19H,2-5,8,17H2,1H3