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

Systemtic Name: [6-ethyl-7-oxidanyl-4-oxidanylidene-3-(1,3-thiazol-4-yl)chromen-8-yl]methyl-dimethyl-azanium Openeye Name: (6-ethyl-7-hydroxy-4-oxo-3-thiazol-4-yl-chromen-8-yl)methyl-dimethyl-ammonium CAS Name: [6-ethyl-7-hydroxy-4-oxo-3-(4-thiazolyl)-1-benzopyran-8-yl]methyl-dimethylammonium IUPAC Name: [6-ethyl-7-hydroxy-4-oxo-3-(1,3-thiazol-4-yl)chromen-8-yl]methyl-dimethylazanium Traditional Name: (6-ethyl-7-hydroxy-4-keto-3-thiazol-4-yl-chromen-8-yl)methyl-dimethyl-ammonium Formula: C17H19N2O3S+ MolecularWeight: 331.40936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=CSC=N3)C[NH+](C)C)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=CSC=N3)C[NH+](C)C)O

InChI

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