(2R,3S,4R)-4-(2-bromanyl-5-methoxy-phenyl)-4-methoxy-3-[2-methoxy-6-[(1S)-1-methylsulfanylethyl]phenyl]selanyl-butan-2-ol

Systemtic Name: (2R,3S,4R)-4-(2-bromanyl-5-methoxy-phenyl)-4-methoxy-3-[2-methoxy-6-[(1S)-1-methylsulfanylethyl]phenyl]selanyl-butan-2-ol Openeye Name: (2R,3S,4R)-4-(2-bromo-5-methoxy-phenyl)-4-methoxy-3-[2-methoxy-6-[(1S)-1-methylsulfanylethyl]phenyl]selanyl-butan-2-ol CAS Name: (2R,3S,4R)-4-(2-bromo-5-methoxyphenyl)-4-methoxy-3-[[2-methoxy-6-[(1S)-1-(methylthio)ethyl]phenyl]seleno]-2-butanol IUPAC Name: (2R,3S,4R)-4-(2-bromo-5-methoxyphenyl)-4-methoxy-3-[2-methoxy-6-[(1S)-1-methylsulfanylethyl]phenyl]selanylbutan-2-ol Traditional Name: (2R,3S,4R)-4-(2-bromo-5-methoxy-phenyl)-4-methoxy-3-[[2-methoxy-6-[(1S)-1-(methylthio)ethyl]phenyl]seleno]butan-2-ol Formula: C22H29BrO4SSe MolecularWeight: 548.39226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=CC=C1)OC)[Se]C(C(C)O)C(C2=C(C=CC(=C2)OC)Br)OC)SC

Isomeric SMILES

C[C@@H](C1=C(C(=CC=C1)OC)[Se][C@@H]([C@@H](C)O)[C@@H](C2=C(C=CC(=C2)OC)Br)OC)SC

InChI

InChI=1S/C22H29BrO4SSe/c1-13(24)21(20(27-5)17-12-15(25-3)10-11-18(17)23)29-22-16(14(2)28-6)8-7-9-19(22)26-4/h7-14,20-21,24H,1-6H3/t13-,14+,20-,21+/m1/s1