ethyl 5-ethoxy-3-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethanoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-ethoxy-3-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 5-ethoxy-3-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate CAS Name: 5-ethoxy-3-[[1-oxo-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-ethoxy-3-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate Traditional Name: 5-ethoxy-3-[[2-[4-[3-(trifluoromethyl)phenyl]piperazino]acetyl]amino]-1H-indole-2-carboxylic acid ethyl ester Formula: C26H29F3N4O4 MolecularWeight: 518.52807

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)C(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=C2NC(=O)CN3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)C(=O)OCC

InChI

InChI=1S/C26H29F3N4O4/c1-3-36-19-8-9-21-20(15-19)23(24(30-21)25(35)37-4-2)31-22(34)16-32-10-12-33(13-11-32)18-7-5-6-17(14-18)26(27,28)29/h5-9,14-15,30H,3-4,10-13,16H2,1-2H3,(H,31,34)