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

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(4-phenylazanylphenyl)-1,3-benzoxazole-4-carboxamide Openeye Name: 2-(4-anilinophenyl)-N-quinuclidin-3-yl-1,3-benzoxazole-4-carboxamide CAS Name: 2-(4-anilinophenyl)-N-(1-azabicyclo[2.2.2]octan-3-yl)-1,3-benzoxazole-4-carboxamide IUPAC Name: 2-(4-anilinophenyl)-N-(1-azabicyclo[2.2.2]octan-3-yl)-1,3-benzoxazole-4-carboxamide Traditional Name: 2-(4-anilinophenyl)-N-quinuclidin-3-yl-1,3-benzoxazole-4-carboxamide Formula: C27H26N4O2 MolecularWeight: 438.52094

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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)NC6=CC=CC=C6

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=C4C(=CC=C3)OC(=N4)C5=CC=C(C=C5)NC6=CC=CC=C6

InChI

InChI=1S/C27H26N4O2/c32-26(29-23-17-31-15-13-18(23)14-16-31)22-7-4-8-24-25(22)30-27(33-24)19-9-11-21(12-10-19)28-20-5-2-1-3-6-20/h1-12,18,23,28H,13-17H2,(H,29,32)