[1-[(Z)-2-(dimethylamino)-2-(2-iodanylphenyl)ethenyl]biphenylen-2-yl] benzenesulfonate

Systemtic Name: [1-[(Z)-2-(dimethylamino)-2-(2-iodanylphenyl)ethenyl]biphenylen-2-yl] benzenesulfonate Openeye Name: [1-[(Z)-2-(dimethylamino)-2-(2-iodophenyl)vinyl]biphenylen-2-yl] benzenesulfonate CAS Name: benzenesulfonic acid [1-[(Z)-2-(dimethylamino)-2-(2-iodophenyl)ethenyl]-2-biphenylenyl] ester IUPAC Name: [1-[(Z)-2-(dimethylamino)-2-(2-iodophenyl)ethenyl]biphenylen-2-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [1-[(Z)-2-(dimethylamino)-2-(2-iodophenyl)vinyl]biphenylen-2-yl] ester Formula: C28H22INO3S MolecularWeight: 579.44865

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=CC1=C(C=CC2=C1C3=CC=CC=C23)OS(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5I

Isomeric SMILES

CN(C)/C(=C\C1=C(C=CC2=C1C3=CC=CC=C23)OS(=O)(=O)C4=CC=CC=C4)/C5=CC=CC=C5I

InChI

InChI=1S/C28H22INO3S/c1-30(2)26(23-14-8-9-15-25(23)29)18-24-27(33-34(31,32)19-10-4-3-5-11-19)17-16-22-20-12-6-7-13-21(20)28(22)24/h3-18H,1-2H3/b26-18-