(1,5-dimethyl-2-naphthalen-1-yl-3H-pyrazol-3-yl) 4-(trifluoromethylsulfonyl)benzoate

Systemtic Name: (1,5-dimethyl-2-naphthalen-1-yl-3H-pyrazol-3-yl) 4-(trifluoromethylsulfonyl)benzoate Openeye Name: [1,5-dimethyl-2-(1-naphthyl)-3H-pyrazol-3-yl] 4-(trifluoromethylsulfonyl)benzoate CAS Name: 4-(trifluoromethylsulfonyl)benzoic acid [1,5-dimethyl-2-(1-naphthalenyl)-3H-pyrazol-3-yl] ester IUPAC Name: (1,5-dimethyl-2-naphthalen-1-yl-3H-pyrazol-3-yl) 4-(trifluoromethylsulfonyl)benzoate Traditional Name: 4-triflylbenzoic acid [1,5-dimethyl-2-(1-naphthyl)-3-pyrazolin-3-yl] ester Formula: C23H19F3N2O4S MolecularWeight: 476.46817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(N1C)C2=CC=CC3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=CC(N(N1C)C2=CC=CC3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C23H19F3N2O4S/c1-15-14-21(28(27(15)2)20-9-5-7-16-6-3-4-8-19(16)20)32-22(29)17-10-12-18(13-11-17)33(30,31)23(24,25)26/h3-14,21H,1-2H3