1-azabicyclo[2.2.2]octane; 2-oxidanylidene-2-[[3-[oxidanyl(phenyl)methyl]-1,2,4-thiadiazol-5-yl]oxy]ethanoic acid

Systemtic Name: 1-azabicyclo[2.2.2]octane; 2-oxidanylidene-2-[[3-[oxidanyl(phenyl)methyl]-1,2,4-thiadiazol-5-yl]oxy]ethanoic acid Openeye Name: 2-[[3-[hydroxy(phenyl)methyl]-1,2,4-thiadiazol-5-yl]oxy]-2-oxo-acetic acid; quinuclidine CAS Name: 1-azabicyclo[2.2.2]octane; 2-[[3-[hydroxy(phenyl)methyl]-1,2,4-thiadiazol-5-yl]oxy]-2-oxoacetic acid IUPAC Name: 1-azabicyclo[2.2.2]octane; 2-[[3-[hydroxy(phenyl)methyl]-1,2,4-thiadiazol-5-yl]oxy]-2-oxoacetic acid Traditional Name: 2-[[3-[hydroxy(phenyl)methyl]-1,2,4-thiadiazol-5-yl]oxy]-2-keto-acetic acid; quinuclidine Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1CC2.C1=CC=C(C=C1)C(C2=NSC(=N2)OC(=O)C(=O)O)O

Isomeric SMILES

C1CN2CCC1CC2.C1=CC=C(C=C1)C(C2=NSC(=N2)OC(=O)C(=O)O)O

InChI

InChI=1S/C11H8N2O5S.C7H13N/c14-7(6-4-2-1-3-5-6)8-12-11(19-13-8)18-10(17)9(15)16;1-4-8-5-2-7(1)3-6-8/h1-5,7,14H,(H,15,16);7H,1-6H2