[1-(phenylmethyl)-5-[4-(trifluoromethyloxy)phenyl]indol-3-yl] 2-oxidanylideneethanoate

Systemtic Name: [1-(phenylmethyl)-5-[4-(trifluoromethyloxy)phenyl]indol-3-yl] 2-oxidanylideneethanoate Openeye Name: [1-benzyl-5-[4-(trifluoromethoxy)phenyl]indol-3-yl] 2-oxoacetate CAS Name: 2-oxoacetic acid [1-(phenylmethyl)-5-[4-(trifluoromethoxy)phenyl]-3-indolyl] ester IUPAC Name: [1-benzyl-5-[4-(trifluoromethoxy)phenyl]indol-3-yl] 2-oxoacetate Traditional Name: 2-ketoacetic acid [1-benzyl-5-[4-(trifluoromethoxy)phenyl]indol-3-yl] ester Formula: C24H16F3NO4 MolecularWeight: 439.38335

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=C2C=CC(=C3)C4=CC=C(C=C4)OC(F)(F)F)OC(=O)C=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=C2C=CC(=C3)C4=CC=C(C=C4)OC(F)(F)F)OC(=O)C=O

InChI

InChI=1S/C24H16F3NO4/c25-24(26,27)32-19-9-6-17(7-10-19)18-8-11-21-20(12-18)22(31-23(30)15-29)14-28(21)13-16-4-2-1-3-5-16/h1-12,14-15H,13H2