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

Systemtic Name: [6-hexyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxidanylidene-chromen-7-yl] methanoate Openeye Name: [6-hexyl-3-(4-methylthiazol-2-yl)-4-oxo-chromen-7-yl] formate CAS Name: formic acid [6-hexyl-3-(4-methyl-2-thiazolyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [6-hexyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxochromen-7-yl] formate Traditional Name: formic acid [6-hexyl-4-keto-3-(4-methylthiazol-2-yl)chromen-7-yl] ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO4S/c1-3-4-5-6-7-14-8-15-18(9-17(14)25-12-22)24-10-16(19(15)23)20-21-13(2)11-26-20/h8-12H,3-7H2,1-2H3