[3-(4-methoxyphenyl)-5-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-dimethyl-azanium

Systemtic Name: [3-(4-methoxyphenyl)-5-methyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-dimethyl-azanium Openeye Name: [7-hydroxy-3-(4-methoxyphenyl)-5-methyl-4-oxo-chromen-8-yl]methyl-dimethyl-ammonium CAS Name: [7-hydroxy-3-(4-methoxyphenyl)-5-methyl-4-oxo-1-benzopyran-8-yl]methyl-dimethylammonium IUPAC Name: [7-hydroxy-3-(4-methoxyphenyl)-5-methyl-4-oxochromen-8-yl]methyl-dimethylazanium Traditional Name: [7-hydroxy-4-keto-3-(4-methoxyphenyl)-5-methyl-chromen-8-yl]methyl-dimethyl-ammonium Formula: C20H22NO4+ MolecularWeight: 340.39298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)C(=CO2)C3=CC=C(C=C3)OC)C[NH+](C)C)O

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)C(=CO2)C3=CC=C(C=C3)OC)C[NH+](C)C)O

InChI

InChI=1S/C20H21NO4/c1-12-9-17(22)15(10-21(2)3)20-18(12)19(23)16(11-25-20)13-5-7-14(24-4)8-6-13/h5-9,11,22H,10H2,1-4H3/p+1