5,9-dimethyl-3-[(4-methylpyridin-1-ium-1-yl)methyl]-2,3-dihydrofuro[3,2-g]chromen-7-one iodide

Systemtic Name: 5,9-dimethyl-3-[(4-methylpyridin-1-ium-1-yl)methyl]-2,3-dihydrofuro[3,2-g]chromen-7-one iodide Openeye Name: 5,9-dimethyl-3-[(4-methylpyridin-1-ium-1-yl)methyl]-2,3-dihydrofuro[3,2-g]chromen-7-one iodide CAS Name: 5,9-dimethyl-3-[(4-methyl-1-pyridin-1-iumyl)methyl]-2,3-dihydrofuro[3,2-g][1]benzopyran-7-one iodide IUPAC Name: 5,9-dimethyl-3-[(4-methylpyridin-1-ium-1-yl)methyl]-2,3-dihydrofuro[3,2-g]chromen-7-one iodide Traditional Name: 5,9-dimethyl-3-[(4-methylpyridin-1-ium-1-yl)methyl]-2,3-dihydrofuro[3,2-g]chromen-7-one iodide Formula: C20H20INO3 MolecularWeight: 449.28217

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)CC2COC3=C2C=C4C(=CC(=O)OC4=C3C)C.[I-]

Isomeric SMILES

CC1=CC=[N+](C=C1)CC2COC3=C2C=C4C(=CC(=O)OC4=C3C)C.[I-]

InChI

InChI=1S/C20H20NO3.HI/c1-12-4-6-21(7-5-12)10-15-11-23-19-14(3)20-16(9-17(15)19)13(2)8-18(22)24-20;/h4-9,15H,10-11H2,1-3H3;1H/q+1;/p-1