N-(1-azabicyclo[2.2.2]octan-3-yl)-6-bromanyl-2-(4-methylphenyl)-1,3-benzoxazole-4-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-6-bromanyl-2-(4-methylphenyl)-1,3-benzoxazole-4-carboxamide Openeye Name: 6-bromo-2-(p-tolyl)-N-quinuclidin-3-yl-1,3-benzoxazole-4-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-6-bromo-2-(4-methylphenyl)-1,3-benzoxazole-4-carboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-6-bromo-2-(4-methylphenyl)-1,3-benzoxazole-4-carboxamide Traditional Name: 6-bromo-2-(p-tolyl)-N-quinuclidin-3-yl-1,3-benzoxazole-4-carboxamide Formula: C22H22BrN3O2 MolecularWeight: 440.33298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(O2)C=C(C=C3C(=O)NC4CN5CCC4CC5)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(O2)C=C(C=C3C(=O)NC4CN5CCC4CC5)Br

InChI

InChI=1S/C22H22BrN3O2/c1-13-2-4-15(5-3-13)22-25-20-17(10-16(23)11-19(20)28-22)21(27)24-18-12-26-8-6-14(18)7-9-26/h2-5,10-11,14,18H,6-9,12H2,1H3,(H,24,27)