Nom: trifluoromethanesulphonic acid 3-cyano-6-cyclopropyl-4-(4-nitro-phenyl)-pyridin-2-yl ester

IUPAC: [3-cyano-6-cyclopropyl-4-(4-nitrophenyl)-2-pyridinyl] trifluoromethanesulfonate

SMILES: N#Cc1c(-c2ccc([N+](=O)[O-])cc2)cc(C2CC2)nc1OS(=O)(=O)C(F)(F)F

Canonical SMILES: C1CC1C2=NC(=C(C(=C2)C3=CC=C(C=C3)[N+](=O)[O-])C#N)OS(=O)(=O)C(F)(F)F

Formule moléculaire: C16H10F3N3O5S

Masse molaire: 413.30

InChIKey: JTRIZJQAJGNVNX-UHFFFAOYSA-N

InChI:

InChI=1S/C16H10F3N3O5S/c17-16(18,19)28(25,26)27-15-13(8-20)12(7-14(21-15)10-1-2-10)9-3-5-11(6-4-9)22(23)24/h3-7,10H,1-2H2

Synonymes

Trifluoromethanesulphonic acid 3-cyano-6-cyclopropyl-4-(4-nitro-phenyl)-pyridin-2-yl esterSCHEMBL2817003