(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-methylsulfonylbenzoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-methylsulfonylbenzoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C19H15ClO6S MolecularWeight: 406.8368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C19H15ClO6S/c1-11-7-17-15(9-16(11)20)13(8-18(21)26-17)10-25-19(22)12-3-5-14(6-4-12)27(2,23)24/h3-9H,10H2,1-2H3