4-azanyl-5-chloranyl-N-[(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)methyl]-2-prop-2-enoxy-benzamide

Systemtic Name: 4-azanyl-5-chloranyl-N-[(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)methyl]-2-prop-2-enoxy-benzamide Openeye Name: 2-allyloxy-4-amino-5-chloro-N-[(3-hydroxyquinuclidin-3-yl)methyl]benzamide CAS Name: 4-amino-5-chloro-N-[(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)methyl]-2-prop-2-enoxybenzamide IUPAC Name: 4-amino-5-chloro-N-[(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)methyl]-2-prop-2-enoxybenzamide Traditional Name: 2-allyloxy-4-amino-5-chloro-N-[(3-hydroxyquinuclidin-3-yl)methyl]benzamide Formula: C18H24ClN3O3 MolecularWeight: 365.85446

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC(=C(C=C1C(=O)NCC2(CN3CCC2CC3)O)Cl)N

Isomeric SMILES

C=CCOC1=CC(=C(C=C1C(=O)NCC2(CN3CCC2CC3)O)Cl)N

InChI

InChI=1S/C18H24ClN3O3/c1-2-7-25-16-9-15(20)14(19)8-13(16)17(23)21-10-18(24)11-22-5-3-12(18)4-6-22/h2,8-9,12,24H,1,3-7,10-11,20H2,(H,21,23)