7-[2-(3-oxidanyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethoxy]chromen-2-one

Systemtic Name: 7-[2-(3-oxidanyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethoxy]chromen-2-one Openeye Name: 7-[2-(3-hydroxyquinuclidin-1-ium-1-yl)ethoxy]chromen-2-one CAS Name: 7-[2-(3-hydroxy-1-azoniabicyclo[2.2.2]octan-1-yl)ethoxy]-1-benzopyran-2-one IUPAC Name: 7-[2-(3-hydroxy-1-azoniabicyclo[2.2.2]octan-1-yl)ethoxy]chromen-2-one Traditional Name: 7-[2-(3-hydroxyquinuclidin-1-ium-1-yl)ethoxy]coumarin Formula: C18H22NO4+ MolecularWeight: 316.37158

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1C(C2)O)CCOC3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

C1C[N+]2(CCC1C(C2)O)CCOC3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C18H22NO4/c20-16-12-19(7-5-13(16)6-8-19)9-10-22-15-3-1-14-2-4-18(21)23-17(14)11-15/h1-4,11,13,16,20H,5-10,12H2/q+1