dimethyl-[[5-methyl-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl]azanium

Systemtic Name: dimethyl-[[5-methyl-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl]azanium Openeye Name: [7-hydroxy-5-methyl-3-(4-methylthiazol-2-yl)-4-oxo-chromen-8-yl]methyl-dimethyl-ammonium CAS Name: [7-hydroxy-5-methyl-3-(4-methyl-2-thiazolyl)-4-oxo-1-benzopyran-8-yl]methyl-dimethylammonium IUPAC Name: [7-hydroxy-5-methyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxochromen-8-yl]methyl-dimethylazanium Traditional Name: [7-hydroxy-4-keto-5-methyl-3-(4-methylthiazol-2-yl)chromen-8-yl]methyl-dimethyl-ammonium Formula: C17H19N2O3S+ MolecularWeight: 331.40936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)C(=CO2)C3=NC(=CS3)C)C[NH+](C)C)O

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)C(=CO2)C3=NC(=CS3)C)C[NH+](C)C)O

InChI

InChI=1S/C17H18N2O3S/c1-9-5-13(20)11(6-19(3)4)16-14(9)15(21)12(7-22-16)17-18-10(2)8-23-17/h5,7-8,20H,6H2,1-4H3/p+1