1-[2-[[4-(1H-indol-3-yl)-1-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 1-[2-[[4-(1H-indol-3-yl)-1-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 1-[2-[[1-carboxy-3-(1H-indol-3-yl)-3-oxo-propyl]amino]propanoyl]pyrrolidine-2-carboxylic acid; 2,2,2-trifluoroacetic acid CAS Name: 1-[2-[[1-hydroxy-4-(1H-indol-3-yl)-1,4-dioxobutan-2-yl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid; 2,2,2-trifluoroacetic acid IUPAC Name: 1-[2-[[1-hydroxy-4-(1H-indol-3-yl)-1,4-dioxobutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid; 2,2,2-trifluoroacetic acid Traditional Name: 1-[2-[[1-carboxy-3-(1H-indol-3-yl)-3-keto-propyl]amino]propanoyl]proline; 2,2,2-trifluoroacetic acid Formula: C22H24F3N3O8 MolecularWeight: 515.43647

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)NC(CC(=O)C2=CNC3=CC=CC=C32)C(=O)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)NC(CC(=O)C2=CNC3=CC=CC=C32)C(=O)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C20H23N3O6.C2HF3O2/c1-11(18(25)23-8-4-7-16(23)20(28)29)22-15(19(26)27)9-17(24)13-10-21-14-6-3-2-5-12(13)14;3-2(4,5)1(6)7/h2-3,5-6,10-11,15-16,21-22H,4,7-9H2,1H3,(H,26,27)(H,28,29);(H,6,7)