(1S)-1-[6-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]ethane-1,2-diol

Systemtic Name: (1S)-1-[6-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]ethane-1,2-diol Openeye Name: (1S)-1-[6-bromo-1-(p-tolylsulfonyl)indol-3-yl]ethane-1,2-diol CAS Name: (1S)-1-[6-bromo-1-(4-methylphenyl)sulfonyl-3-indolyl]ethane-1,2-diol IUPAC Name: (1S)-1-[6-bromo-1-(4-methylphenyl)sulfonylindol-3-yl]ethane-1,2-diol Traditional Name: (1S)-1-(6-bromo-1-tosyl-indol-3-yl)ethane-1,2-diol Formula: C17H16BrNO4S MolecularWeight: 410.28224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=C(C=C3)Br)C(CO)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=C(C=C3)Br)[C@@H](CO)O

InChI

InChI=1S/C17H16BrNO4S/c1-11-2-5-13(6-3-11)24(22,23)19-9-15(17(21)10-20)14-7-4-12(18)8-16(14)19/h2-9,17,20-21H,10H2,1H3/t17-/m1/s1