methyl 2-[3-(4-methylphenyl)sulfonyl-4-oxidanylidene-chromen-7-yl]oxyethanoate

Systemtic Name: methyl 2-[3-(4-methylphenyl)sulfonyl-4-oxidanylidene-chromen-7-yl]oxyethanoate Openeye Name: methyl 2-[4-oxo-3-(p-tolylsulfonyl)chromen-7-yl]oxyacetate CAS Name: 2-[[3-(4-methylphenyl)sulfonyl-4-oxo-1-benzopyran-7-yl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-(4-methylphenyl)sulfonyl-4-oxochromen-7-yl]oxyacetate Traditional Name: 2-(4-keto-3-tosyl-chromen-7-yl)oxyacetic acid methyl ester Formula: C19H16O7S MolecularWeight: 388.39114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=COC3=C(C2=O)C=CC(=C3)OCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=COC3=C(C2=O)C=CC(=C3)OCC(=O)OC

InChI

InChI=1S/C19H16O7S/c1-12-3-6-14(7-4-12)27(22,23)17-10-26-16-9-13(25-11-18(20)24-2)5-8-15(16)19(17)21/h3-10H,11H2,1-2H3