diethyl-[[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl]azanium

Systemtic Name: diethyl-[[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl]azanium Openeye Name: diethyl-[[6-ethyl-7-hydroxy-3-(4-methylthiazol-2-yl)-4-oxo-chromen-8-yl]methyl]ammonium CAS Name: diethyl-[[6-ethyl-7-hydroxy-3-(4-methyl-2-thiazolyl)-4-oxo-1-benzopyran-8-yl]methyl]ammonium IUPAC Name: diethyl-[[6-ethyl-7-hydroxy-3-(4-methyl-1,3-thiazol-2-yl)-4-oxochromen-8-yl]methyl]azanium Traditional Name: diethyl-[[6-ethyl-7-hydroxy-4-keto-3-(4-methylthiazol-2-yl)chromen-8-yl]methyl]ammonium Formula: C20H25N2O3S+ MolecularWeight: 373.4891

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)C[NH+](CC)CC)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)C[NH+](CC)CC)O

InChI

InChI=1S/C20H24N2O3S/c1-5-13-8-14-18(24)16(20-21-12(4)11-26-20)10-25-19(14)15(17(13)23)9-22(6-2)7-3/h8,10-11,23H,5-7,9H2,1-4H3/p+1