tert-butyl 2-[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-chromen-7-yl]oxyethanoate

Systemtic Name: tert-butyl 2-[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-chromen-7-yl]oxyethanoate Openeye Name: tert-butyl 2-[6-ethyl-3-(4-methylthiazol-2-yl)-4-oxo-chromen-7-yl]oxyacetate CAS Name: 2-[[6-ethyl-3-(4-methyl-2-thiazolyl)-4-oxo-1-benzopyran-7-yl]oxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxochromen-7-yl]oxyacetate Traditional Name: 2-[6-ethyl-4-keto-3-(4-methylthiazol-2-yl)chromen-7-yl]oxyacetic acid tert-butyl ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)OCC(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)OCC(=O)OC(C)(C)C

InChI

InChI=1S/C21H23NO5S/c1-6-13-7-14-17(8-16(13)26-10-18(23)27-21(3,4)5)25-9-15(19(14)24)20-22-12(2)11-28-20/h7-9,11H,6,10H2,1-5H3