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

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(4-cyanophenyl)-1,3-benzoxazole-4-carboxamide Openeye Name: 2-(4-cyanophenyl)-N-quinuclidin-3-yl-1,3-benzoxazole-4-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(4-cyanophenyl)-1,3-benzoxazole-4-carboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(4-cyanophenyl)-1,3-benzoxazole-4-carboxamide Traditional Name: 2-(4-cyanophenyl)-N-quinuclidin-3-yl-1,3-benzoxazole-4-carboxamide Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=C4C(=CC=C3)OC(=N4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=C4C(=CC=C3)OC(=N4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C22H20N4O2/c23-12-14-4-6-16(7-5-14)22-25-20-17(2-1-3-19(20)28-22)21(27)24-18-13-26-10-8-15(18)9-11-26/h1-7,15,18H,8-11,13H2,(H,24,27)