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

Systemtic Name: ethyl 2-[3-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-6-pentyl-chromen-7-yl]oxypropanoate Openeye Name: ethyl 2-[3-(4-methylthiazol-2-yl)-4-oxo-6-pentyl-chromen-7-yl]oxypropanoate CAS Name: 2-[[3-(4-methyl-2-thiazolyl)-4-oxo-6-pentyl-1-benzopyran-7-yl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-6-pentylchromen-7-yl]oxypropanoate Traditional Name: 2-[6-amyl-4-keto-3-(4-methylthiazol-2-yl)chromen-7-yl]oxypropionic acid ethyl ester Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)OC(C)C(=O)OCC

Isomeric SMILES

CCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)OC(C)C(=O)OCC

InChI

InChI=1S/C23H27NO5S/c1-5-7-8-9-16-10-17-20(11-19(16)29-15(4)23(26)27-6-2)28-12-18(21(17)25)22-24-14(3)13-30-22/h10-13,15H,5-9H2,1-4H3