[4-(trifluoromethyl)phenyl]methyl 4-(4-methylpiperazin-1-yl)-1H-indole-2-carboxylate

Systemtic Name: [4-(trifluoromethyl)phenyl]methyl 4-(4-methylpiperazin-1-yl)-1H-indole-2-carboxylate Openeye Name: [4-(trifluoromethyl)phenyl]methyl 4-(4-methylpiperazin-1-yl)-1H-indole-2-carboxylate CAS Name: 4-(4-methyl-1-piperazinyl)-1H-indole-2-carboxylic acid [4-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [4-(trifluoromethyl)phenyl]methyl 4-(4-methylpiperazin-1-yl)-1H-indole-2-carboxylate Traditional Name: 4-(4-methylpiperazino)-1H-indole-2-carboxylic acid [4-(trifluoromethyl)benzyl] ester Formula: C22H22F3N3O2 MolecularWeight: 417.42419

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC3=C2C=C(N3)C(=O)OCC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC3=C2C=C(N3)C(=O)OCC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H22F3N3O2/c1-27-9-11-28(12-10-27)20-4-2-3-18-17(20)13-19(26-18)21(29)30-14-15-5-7-16(8-6-15)22(23,24)25/h2-8,13,26H,9-12,14H2,1H3