(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-methylsulfonylbenzoate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-methylsulfonylbenzoate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C19H16O7S MolecularWeight: 388.39114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C3=CC=C(C=C3)S(=O)(=O)C)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C3=CC=C(C=C3)S(=O)(=O)C)O

InChI

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