[2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-1-phenyl-ethyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: [2-[[4-chloranyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-1-phenyl-ethyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenyl-ethyl] 2-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)propanoic acid [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] ester IUPAC Name: [2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 2-phthalimidopropionic acid [2-[4-chloro-3-(trifluoromethyl)anilino]-2-keto-1-phenyl-ethyl] ester Formula: C26H18ClF3N2O5 MolecularWeight: 530.87973

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C(=O)OC(C1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C26H18ClF3N2O5/c1-14(32-23(34)17-9-5-6-10-18(17)24(32)35)25(36)37-21(15-7-3-2-4-8-15)22(33)31-16-11-12-20(27)19(13-16)26(28,29)30/h2-14,21H,1H3,(H,31,33)