[2-[5-methyl-3-(4-methyl-1,3-thiazol-3-ium-2-yl)-4-oxidanylidene-chromen-7-yl]oxy-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[5-methyl-3-(4-methyl-1,3-thiazol-3-ium-2-yl)-4-oxidanylidene-chromen-7-yl]oxy-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[5-methyl-3-(4-methylthiazol-3-ium-2-yl)-4-oxo-chromen-7-yl]oxy-2-oxo-ethyl]ammonium CAS Name: [2-[[5-methyl-3-(4-methyl-2-thiazol-3-iumyl)-4-oxo-1-benzopyran-7-yl]oxy]-2-oxoethyl]ammonium IUPAC Name: [2-[5-methyl-3-(4-methyl-1,3-thiazol-3-ium-2-yl)-4-oxochromen-7-yl]oxy-2-oxoethyl]azanium Traditional Name: [2-keto-2-[4-keto-5-methyl-3-(4-methylthiazol-3-ium-2-yl)chromen-7-yl]oxy-ethyl]ammonium Formula: C16H16N2O4S+2 MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)C(=CO2)C3=[NH+]C(=CS3)C)OC(=O)C[NH3+]

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)C(=CO2)C3=[NH+]C(=CS3)C)OC(=O)C[NH3+]

InChI

InChI=1S/C16H14N2O4S/c1-8-3-10(22-13(19)5-17)4-12-14(8)15(20)11(6-21-12)16-18-9(2)7-23-16/h3-4,6-7H,5,17H2,1-2H3/p+2