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

Systemtic Name: ethyl 2-[6-hexyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: ethyl 2-[6-hexyl-3-(4-methylthiazol-2-yl)-4-oxo-chromen-7-yl]oxypropanoate CAS Name: 2-[[6-hexyl-3-(4-methyl-2-thiazolyl)-4-oxo-1-benzopyran-7-yl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[6-hexyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxochromen-7-yl]oxypropanoate Traditional Name: 2-[6-hexyl-4-keto-3-(4-methylthiazol-2-yl)chromen-7-yl]oxypropionic acid ethyl ester Formula: C24H29NO5S MolecularWeight: 443.55576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)OC(C)C(=O)OCC

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC(=CS3)C)OC(C)C(=O)OCC

InChI

InChI=1S/C24H29NO5S/c1-5-7-8-9-10-17-11-18-21(12-20(17)30-16(4)24(27)28-6-2)29-13-19(22(18)26)23-25-15(3)14-31-23/h11-14,16H,5-10H2,1-4H3