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

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(4-prop-1-ynylphenyl)-1,3-benzoxazole-4-carboxamide Openeye Name: 2-(4-prop-1-ynylphenyl)-N-quinuclidin-3-yl-1,3-benzoxazole-4-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(4-prop-1-ynylphenyl)-1,3-benzoxazole-4-carboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(4-prop-1-ynylphenyl)-1,3-benzoxazole-4-carboxamide Traditional Name: 2-(4-prop-1-ynylphenyl)-N-quinuclidin-3-yl-1,3-benzoxazole-4-carboxamide Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC=C(C=C1)C2=NC3=C(C=CC=C3O2)C(=O)NC4CN5CCC4CC5

Isomeric SMILES

CC#CC1=CC=C(C=C1)C2=NC3=C(C=CC=C3O2)C(=O)NC4CN5CCC4CC5

InChI

InChI=1S/C24H23N3O2/c1-2-4-16-7-9-18(10-8-16)24-26-22-19(5-3-6-21(22)29-24)23(28)25-20-15-27-13-11-17(20)12-14-27/h3,5-10,17,20H,11-15H2,1H3,(H,25,28)