[(2R,3R)-2-(4-bromophenyl)-4-oxidanylidene-2,3-dihydrochromen-3-yl] methanesulfonate

Systemtic Name: [(2R,3R)-2-(4-bromophenyl)-4-oxidanylidene-2,3-dihydrochromen-3-yl] methanesulfonate Openeye Name: [(2R,3R)-2-(4-bromophenyl)-4-oxo-chroman-3-yl] methanesulfonate CAS Name: methanesulfonic acid [(2R,3R)-2-(4-bromophenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(2R,3R)-2-(4-bromophenyl)-4-oxo-2,3-dihydrochromen-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [(2R,3R)-2-(4-bromophenyl)-4-keto-chroman-3-yl] ester Formula: C16H13BrO5S MolecularWeight: 397.24042

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1C(OC2=CC=CC=C2C1=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CS(=O)(=O)O[C@@H]1[C@H](OC2=CC=CC=C2C1=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C16H13BrO5S/c1-23(19,20)22-16-14(18)12-4-2-3-5-13(12)21-15(16)10-6-8-11(17)9-7-10/h2-9,15-16H,1H3/t15-,16+/m1/s1