1-(1-azabicyclo[2.2.2]octan-3-yl)benzimidazole; (E)-but-2-enedioic acid

Systemtic Name: 1-(1-azabicyclo[2.2.2]octan-3-yl)benzimidazole; (E)-but-2-enedioic acid Openeye Name: fumaric acid; 1-quinuclidin-3-ylbenzimidazole CAS Name: 1-(1-azabicyclo[2.2.2]octan-3-yl)benzimidazole; (E)-2-butenedioic acid IUPAC Name: 1-(1-azabicyclo[2.2.2]octan-3-yl)benzimidazole; (E)-but-2-enedioic acid Traditional Name: fumaric acid; 1-quinuclidin-3-ylbenzimidazole Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)N3C=NC4=CC=CC=C43.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CN2CCC1C(C2)N3C=NC4=CC=CC=C43.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H17N3.C4H4O4/c1-2-4-13-12(3-1)15-10-17(13)14-9-16-7-5-11(14)6-8-16;5-3(6)1-2-4(7)8/h1-4,10-11,14H,5-9H2;1-2H,(H,5,6)(H,7,8)/b;2-1+