2-[(E)-2-[4-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]ethenyl]isoindole-1,3-dione

Systemtic Name: 2-[(E)-2-[4-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]ethenyl]isoindole-1,3-dione Openeye Name: 2-[(E)-2-[4-bromo-1-(p-tolylsulfonyl)indol-3-yl]vinyl]isoindoline-1,3-dione CAS Name: 2-[(E)-2-[4-bromo-1-(4-methylphenyl)sulfonyl-3-indolyl]ethenyl]isoindole-1,3-dione IUPAC Name: 2-[(E)-2-[4-bromo-1-(4-methylphenyl)sulfonylindol-3-yl]ethenyl]isoindole-1,3-dione Traditional Name: 2-[(E)-2-(4-bromo-1-tosyl-indol-3-yl)vinyl]isoindoline-1,3-quinone Formula: C25H17BrN2O4S MolecularWeight: 521.38248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC=C3Br)C=CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC=C3Br)/C=C/N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H17BrN2O4S/c1-16-9-11-18(12-10-16)33(31,32)28-15-17(23-21(26)7-4-8-22(23)28)13-14-27-24(29)19-5-2-3-6-20(19)25(27)30/h2-15H,1H3/b14-13+