(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(2,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(2,4-dimethylphenyl)sulfanylethanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-(2,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,4-dimethylphenyl)thio]acetic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-(2,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,4-dimethylphenyl)thio]acetic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C22H22O4S MolecularWeight: 382.47268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C)C)C

InChI

InChI=1S/C22H22O4S/c1-13-5-6-20(16(4)7-13)27-12-22(24)25-11-17-10-21(23)26-19-9-15(3)14(2)8-18(17)19/h5-10H,11-12H2,1-4H3