tert-butyl 4-[2-[4-fluoranyl-7-(methylcarbamoyl)-1H-indol-3-yl]-2-oxidanylidene-ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-fluoranyl-7-(methylcarbamoyl)-1H-indol-3-yl]-2-oxidanylidene-ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-fluoro-7-(methylcarbamoyl)-1H-indol-3-yl]-2-oxo-acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[4-fluoro-7-(methylcarbamoyl)-1H-indol-3-yl]-1,2-dioxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-fluoro-7-(methylcarbamoyl)-1H-indol-3-yl]-2-oxoacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-fluoro-7-(methylcarbamoyl)-1H-indol-3-yl]-2-keto-acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C21H25FN4O5 MolecularWeight: 432.445403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C(=O)C2=CNC3=C(C=CC(=C23)F)C(=O)NC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C(=O)C2=CNC3=C(C=CC(=C23)F)C(=O)NC

InChI

InChI=1S/C21H25FN4O5/c1-21(2,3)31-20(30)26-9-7-25(8-10-26)19(29)17(27)13-11-24-16-12(18(28)23-4)5-6-14(22)15(13)16/h5-6,11,24H,7-10H2,1-4H3,(H,23,28)