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

Systemtic Name: [3-methyl-1-[5-methyl-3-(4-methyl-1,3-thiazol-3-ium-2-yl)-4-oxidanylidene-chromen-7-yl]oxy-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [2-methyl-1-[5-methyl-3-(4-methylthiazol-3-ium-2-yl)-4-oxo-chromen-7-yl]oxycarbonyl-propyl]ammonium CAS Name: [3-methyl-1-[[5-methyl-3-(4-methyl-2-thiazol-3-iumyl)-4-oxo-1-benzopyran-7-yl]oxy]-1-oxobutan-2-yl]ammonium IUPAC Name: [3-methyl-1-[5-methyl-3-(4-methyl-1,3-thiazol-3-ium-2-yl)-4-oxochromen-7-yl]oxy-1-oxobutan-2-yl]azanium Traditional Name: [1-[4-keto-5-methyl-3-(4-methylthiazol-3-ium-2-yl)chromen-7-yl]oxycarbonyl-2-methyl-propyl]ammonium Formula: C19H22N2O4S+2 MolecularWeight: 374.45398

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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(C(C)C)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O4S/c1-9(2)16(20)19(23)25-12-5-10(3)15-14(6-12)24-7-13(17(15)22)18-21-11(4)8-26-18/h5-9,16H,20H2,1-4H3/p+2