2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)pyridin-1-ium-1-yl]-2,3-dihydroinden-1-one

Systemtic Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)pyridin-1-ium-1-yl]-2,3-dihydroinden-1-one Openeye Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)pyridin-1-ium-1-yl]indan-1-one CAS Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-pyridin-1-iumyl]-2,3-dihydroinden-1-one IUPAC Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)pyridin-1-ium-1-yl]-2,3-dihydroinden-1-one Traditional Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)pyridin-1-ium-1-yl]indan-1-one Formula: C22H18NO3+ MolecularWeight: 344.38322

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=CC=C2O1)C3=CC=[N+](C=C3)C4CC5=CC=CC=C5C4=O

Isomeric SMILES

C1COC2=C(C=CC=C2O1)C3=CC=[N+](C=C3)C4CC5=CC=CC=C5C4=O

InChI

InChI=1S/C22H18NO3/c24-21-17-5-2-1-4-16(17)14-19(21)23-10-8-15(9-11-23)18-6-3-7-20-22(18)26-13-12-25-20/h1-11,19H,12-14H2/q+1