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

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-ethylsulfonylbenzoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H20O6S MolecularWeight: 400.4449

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C)C

InChI

InChI=1S/C21H20O6S/c1-4-28(24,25)19-8-6-5-7-16(19)21(23)26-12-15-11-20(22)27-18-10-14(3)13(2)9-17(15)18/h5-11H,4,12H2,1-3H3