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

Systemtic Name: 2-[(4-ethylpyridin-1-ium-1-yl)methyl]-5,9-dimethyl-2,3-dihydrofuro[3,2-g]chromen-7-one Openeye Name: 2-[(4-ethylpyridin-1-ium-1-yl)methyl]-5,9-dimethyl-2,3-dihydrofuro[3,2-g]chromen-7-one CAS Name: 2-[(4-ethyl-1-pyridin-1-iumyl)methyl]-5,9-dimethyl-2,3-dihydrofuro[3,2-g][1]benzopyran-7-one IUPAC Name: 2-[(4-ethylpyridin-1-ium-1-yl)methyl]-5,9-dimethyl-2,3-dihydrofuro[3,2-g]chromen-7-one Traditional Name: 2-[(4-ethylpyridin-1-ium-1-yl)methyl]-5,9-dimethyl-2,3-dihydrofuro[3,2-g]chromen-7-one Formula: C21H22NO3+ MolecularWeight: 336.40428

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=[N+](C=C1)CC2CC3=C(O2)C(=C4C(=C3)C(=CC(=O)O4)C)C

Isomeric SMILES

CCC1=CC=[N+](C=C1)CC2CC3=C(O2)C(=C4C(=C3)C(=CC(=O)O4)C)C

InChI

InChI=1S/C21H22NO3/c1-4-15-5-7-22(8-6-15)12-17-10-16-11-18-13(2)9-19(23)25-21(18)14(3)20(16)24-17/h5-9,11,17H,4,10,12H2,1-3H3/q+1