(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(R)-ethylsulfinyl]benzoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(R)-ethylsulfinyl]benzoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-[(R)-ethylsulfinyl]benzoate CAS Name: 2-[(R)-ethylsulfinyl]benzoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-[(R)-ethylsulfinyl]benzoate Traditional Name: 2-[(R)-ethylsulfinyl]benzoic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H20O5S MolecularWeight: 384.4455

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[S@@](=O)C1=CC=CC=C1C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C)C

InChI

InChI=1S/C21H20O5S/c1-4-27(24)19-8-6-5-7-16(19)21(23)25-12-15-11-20(22)26-18-10-14(3)13(2)9-17(15)18/h5-11H,4,12H2,1-3H3/t27-/m1/s1