2-[2-[(phenylmethyl)amino]-3-(trifluoromethyl)indol-3-yl]ethanoate

Systemtic Name: 2-[2-[(phenylmethyl)amino]-3-(trifluoromethyl)indol-3-yl]ethanoate Openeye Name: 2-[2-(benzylamino)-3-(trifluoromethyl)indol-3-yl]acetate CAS Name: 2-[2-[(phenylmethyl)amino]-3-(trifluoromethyl)-3-indolyl]acetate IUPAC Name: 2-[2-(benzylamino)-3-(trifluoromethyl)indol-3-yl]acetate Traditional Name: 2-[2-(benzylamino)-3-(trifluoromethyl)indol-3-yl]acetate Formula: C18H14F3N2O2- MolecularWeight: 347.31117

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3C2(CC(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3C2(CC(=O)[O-])C(F)(F)F

InChI

InChI=1S/C18H15F3N2O2/c19-18(20,21)17(10-15(24)25)13-8-4-5-9-14(13)23-16(17)22-11-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,22,23)(H,24,25)/p-1