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

Systemtic Name: [6-hexyl-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-chromen-7-yl] ethanoate Openeye Name: [6-hexyl-3-(4-methylthiazol-2-yl)-2-oxo-chromen-7-yl] acetate CAS Name: acetic acid [6-hexyl-3-(4-methyl-2-thiazolyl)-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [6-hexyl-3-(4-methyl-1,3-thiazol-2-yl)-2-oxochromen-7-yl] acetate Traditional Name: acetic acid [6-hexyl-2-keto-3-(4-methylthiazol-2-yl)chromen-7-yl] ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=NC(=CS3)C)OC(=O)C

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=NC(=CS3)C)OC(=O)C

InChI

InChI=1S/C21H23NO4S/c1-4-5-6-7-8-15-9-16-10-17(20-22-13(2)12-27-20)21(24)26-19(16)11-18(15)25-14(3)23/h9-12H,4-8H2,1-3H3