ethyl 3-[3-fluoranyl-4-(trifluoromethyl)phenyl]-3-(6-phenylmethoxy-1H-indol-3-yl)propanoate

Systemtic Name: ethyl 3-[3-fluoranyl-4-(trifluoromethyl)phenyl]-3-(6-phenylmethoxy-1H-indol-3-yl)propanoate Openeye Name: ethyl 3-(6-benzyloxy-1H-indol-3-yl)-3-[3-fluoro-4-(trifluoromethyl)phenyl]propanoate CAS Name: 3-[3-fluoro-4-(trifluoromethyl)phenyl]-3-(6-phenylmethoxy-1H-indol-3-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-fluoro-4-(trifluoromethyl)phenyl]-3-(6-phenylmethoxy-1H-indol-3-yl)propanoate Traditional Name: 3-(6-benzoxy-1H-indol-3-yl)-3-[3-fluoro-4-(trifluoromethyl)phenyl]propionic acid ethyl ester Formula: C27H23F4NO3 MolecularWeight: 485.470033

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC(=C(C=C1)C(F)(F)F)F)C2=CNC3=C2C=CC(=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CC(C1=CC(=C(C=C1)C(F)(F)F)F)C2=CNC3=C2C=CC(=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H23F4NO3/c1-2-34-26(33)14-21(18-8-11-23(24(28)12-18)27(29,30)31)22-15-32-25-13-19(9-10-20(22)25)35-16-17-6-4-3-5-7-17/h3-13,15,21,32H,2,14,16H2,1H3