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

Systemtic Name: ethyl 5-methoxy-3-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethanoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 5-methoxy-3-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate CAS Name: 5-methoxy-3-[[1-oxo-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methoxy-3-[[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetyl]amino]-1H-indole-2-carboxylate Traditional Name: 5-methoxy-3-[[2-[4-[3-(trifluoromethyl)phenyl]piperazino]acetyl]amino]-1H-indole-2-carboxylic acid ethyl ester Formula: C25H27F3N4O4 MolecularWeight: 504.50149

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CN3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CN3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C25H27F3N4O4/c1-3-36-24(34)23-22(19-14-18(35-2)7-8-20(19)29-23)30-21(33)15-31-9-11-32(12-10-31)17-6-4-5-16(13-17)25(26,27)28/h4-8,13-14,29H,3,9-12,15H2,1-2H3,(H,30,33)