3-bromanyl-7-methoxy-2,2-dimethyl-6-(4-methylphenyl)sulfonyl-3,4-dihydrochromen-4-ol

Systemtic Name: 3-bromanyl-7-methoxy-2,2-dimethyl-6-(4-methylphenyl)sulfonyl-3,4-dihydrochromen-4-ol Openeye Name: 3-bromo-7-methoxy-2,2-dimethyl-6-(p-tolylsulfonyl)chroman-4-ol CAS Name: 3-bromo-7-methoxy-2,2-dimethyl-6-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-1-benzopyran-4-ol IUPAC Name: 3-bromo-7-methoxy-2,2-dimethyl-6-(4-methylphenyl)sulfonyl-3,4-dihydrochromen-4-ol Traditional Name: 3-bromo-7-methoxy-2,2-dimethyl-6-tosyl-chroman-4-ol Formula: C19H21BrO5S MolecularWeight: 441.33604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C3C(=C2)C(C(C(O3)(C)C)Br)O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C3C(=C2)C(C(C(O3)(C)C)Br)O)OC

InChI

InChI=1S/C19H21BrO5S/c1-11-5-7-12(8-6-11)26(22,23)16-9-13-14(10-15(16)24-4)25-19(2,3)18(20)17(13)21/h5-10,17-18,21H,1-4H3