dimethyl-[3-[2-[3-(2-methyl-1,3-thiazol-4-yl)-2-oxidanylidene-chromen-7-yl]oxyethanoylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[2-[3-(2-methyl-1,3-thiazol-4-yl)-2-oxidanylidene-chromen-7-yl]oxyethanoylamino]propyl]azanium Openeye Name: dimethyl-[3-[[2-[3-(2-methylthiazol-4-yl)-2-oxo-chromen-7-yl]oxyacetyl]amino]propyl]ammonium CAS Name: dimethyl-[3-[[2-[[3-(2-methyl-4-thiazolyl)-2-oxo-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[2-[3-(2-methyl-1,3-thiazol-4-yl)-2-oxochromen-7-yl]oxyacetyl]amino]propyl]azanium Traditional Name: 3-[[2-[2-keto-3-(2-methylthiazol-4-yl)chromen-7-yl]oxyacetyl]amino]propyl-dimethyl-ammonium Formula: C20H24N3O4S+ MolecularWeight: 402.48726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC3=C(C=C(C=C3)OCC(=O)NCCC[NH+](C)C)OC2=O

Isomeric SMILES

CC1=NC(=CS1)C2=CC3=C(C=C(C=C3)OCC(=O)NCCC[NH+](C)C)OC2=O

InChI

InChI=1S/C20H23N3O4S/c1-13-22-17(12-28-13)16-9-14-5-6-15(10-18(14)27-20(16)25)26-11-19(24)21-7-4-8-23(2)3/h5-6,9-10,12H,4,7-8,11H2,1-3H3,(H,21,24)/p+1