ethyl (2R)-2-[6-ethyl-4-oxidanylidene-3-(4-phenyl-1,3-thiazol-2-yl)chromen-7-yl]oxypropanoate

Systemtic Name: ethyl (2R)-2-[6-ethyl-4-oxidanylidene-3-(4-phenyl-1,3-thiazol-2-yl)chromen-7-yl]oxypropanoate Openeye Name: ethyl (2R)-2-[6-ethyl-4-oxo-3-(4-phenylthiazol-2-yl)chromen-7-yl]oxypropanoate CAS Name: (2R)-2-[[6-ethyl-4-oxo-3-(4-phenyl-2-thiazolyl)-1-benzopyran-7-yl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-[6-ethyl-4-oxo-3-(4-phenyl-1,3-thiazol-2-yl)chromen-7-yl]oxypropanoate Traditional Name: (2R)-2-[6-ethyl-4-keto-3-(4-phenylthiazol-2-yl)chromen-7-yl]oxypropionic acid ethyl ester Formula: C25H23NO5S MolecularWeight: 449.51882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C4=CC=CC=C4)OC(C)C(=O)OCC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C4=CC=CC=C4)O[C@H](C)C(=O)OCC

InChI

InChI=1S/C25H23NO5S/c1-4-16-11-18-22(12-21(16)31-15(3)25(28)29-5-2)30-13-19(23(18)27)24-26-20(14-32-24)17-9-7-6-8-10-17/h6-15H,4-5H2,1-3H3/t15-/m1/s1