[1-[cyano(dimethylamino)methyl]biphenylen-2-yl] benzenesulfonate

Systemtic Name: [1-[cyano(dimethylamino)methyl]biphenylen-2-yl] benzenesulfonate Openeye Name: [1-[cyano(dimethylamino)methyl]biphenylen-2-yl] benzenesulfonate CAS Name: benzenesulfonic acid [1-[cyano(dimethylamino)methyl]-2-biphenylenyl] ester IUPAC Name: [1-[cyano(dimethylamino)methyl]biphenylen-2-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [1-[cyano(dimethylamino)methyl]biphenylen-2-yl] ester Formula: C22H18N2O3S MolecularWeight: 390.45492

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(C#N)C1=C(C=CC2=C1C3=CC=CC=C23)OS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CN(C)C(C#N)C1=C(C=CC2=C1C3=CC=CC=C23)OS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O3S/c1-24(2)19(14-23)22-20(27-28(25,26)15-8-4-3-5-9-15)13-12-18-16-10-6-7-11-17(16)21(18)22/h3-13,19H,1-2H3