[3-(3,4-dimethoxyphenyl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-(2-hydroxyethyl)azanium

Systemtic Name: [3-(3,4-dimethoxyphenyl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-(2-hydroxyethyl)azanium Openeye Name: [3-(3,4-dimethoxyphenyl)-7-hydroxy-4-oxo-chromen-8-yl]methyl-(2-hydroxyethyl)ammonium CAS Name: [3-(3,4-dimethoxyphenyl)-7-hydroxy-4-oxo-1-benzopyran-8-yl]methyl-(2-hydroxyethyl)ammonium IUPAC Name: [3-(3,4-dimethoxyphenyl)-7-hydroxy-4-oxochromen-8-yl]methyl-(2-hydroxyethyl)azanium Traditional Name: [3-(3,4-dimethoxyphenyl)-7-hydroxy-4-keto-chromen-8-yl]methyl-(2-hydroxyethyl)ammonium Formula: C20H22NO6+ MolecularWeight: 372.39178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3C[NH2+]CCO)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3C[NH2+]CCO)O)OC

InChI

InChI=1S/C20H21NO6/c1-25-17-6-3-12(9-18(17)26-2)15-11-27-20-13(19(15)24)4-5-16(23)14(20)10-21-7-8-22/h3-6,9,11,21-23H,7-8,10H2,1-2H3/p+1