[2-(7-cyanonaphthalen-2-yl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-(7-cyanonaphthalen-2-yl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl] tris(fluoranyl)methanesulfonate Openeye Name: [2-(7-cyano-2-naphthyl)-1-ethylsulfonyl-indolin-5-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-(7-cyano-2-naphthalenyl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl] ester IUPAC Name: [2-(7-cyanonaphthalen-2-yl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-(7-cyano-2-naphthyl)-1-esyl-indolin-5-yl] ester Formula: C22H17F3N2O5S2 MolecularWeight: 510.50599

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(CC2=C1C=CC(=C2)OS(=O)(=O)C(F)(F)F)C3=CC4=C(C=CC(=C4)C#N)C=C3

Isomeric SMILES

CCS(=O)(=O)N1C(CC2=C1C=CC(=C2)OS(=O)(=O)C(F)(F)F)C3=CC4=C(C=CC(=C4)C#N)C=C3

InChI

InChI=1S/C22H17F3N2O5S2/c1-2-33(28,29)27-20-8-7-19(32-34(30,31)22(23,24)25)11-18(20)12-21(27)16-6-5-15-4-3-14(13-26)9-17(15)10-16/h3-11,21H,2,12H2,1H3