(5S)-1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-(1H-indol-3-ylmethyl)piperazine-2,3-dione

Systemtic Name: (5S)-1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-(1H-indol-3-ylmethyl)piperazine-2,3-dione Openeye Name: (5S)-1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-(1H-indol-3-ylmethyl)piperazine-2,3-dione CAS Name: (5S)-1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-(1H-indol-3-ylmethyl)piperazine-2,3-dione IUPAC Name: (5S)-1-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-(1H-indol-3-ylmethyl)piperazine-2,3-dione Traditional Name: (5S)-1-[3,5-bis(trifluoromethyl)benzyl]-5-(1H-indol-3-ylmethyl)piperazine-2,3-quinone Formula: C22H17F6N3O2 MolecularWeight: 469.379699

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C(=O)N1CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)CC3=CNC4=CC=CC=C43

Isomeric SMILES

C1[C@@H](NC(=O)C(=O)N1CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H17F6N3O2/c23-21(24,25)14-5-12(6-15(8-14)22(26,27)28)10-31-11-16(30-19(32)20(31)33)7-13-9-29-18-4-2-1-3-17(13)18/h1-6,8-9,16,29H,7,10-11H2,(H,30,32)/t16-/m0/s1