methyl 2-[4-fluoranyl-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]-1H-indol-7-yl]-1H-imidazole-5-carboxylate

Systemtic Name: methyl 2-[4-fluoranyl-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]-1H-indol-7-yl]-1H-imidazole-5-carboxylate Openeye Name: methyl 2-[3-[2-(4-benzoylpiperazin-1-yl)-2-oxo-acetyl]-4-fluoro-1H-indol-7-yl]-1H-imidazole-5-carboxylate CAS Name: 2-[3-[2-(4-benzoyl-1-piperazinyl)-1,2-dioxoethyl]-4-fluoro-1H-indol-7-yl]-1H-imidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[3-[2-(4-benzoylpiperazin-1-yl)-2-oxoacetyl]-4-fluoro-1H-indol-7-yl]-1H-imidazole-5-carboxylate Traditional Name: 2-[3-[2-(4-benzoylpiperazino)-2-keto-acetyl]-4-fluoro-1H-indol-7-yl]-1H-imidazole-5-carboxylic acid methyl ester Formula: C26H22FN5O5 MolecularWeight: 503.481783

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(N1)C2=C3C(=C(C=C2)F)C(=CN3)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CN=C(N1)C2=C3C(=C(C=C2)F)C(=CN3)C(=O)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H22FN5O5/c1-37-26(36)19-14-29-23(30-19)16-7-8-18(27)20-17(13-28-21(16)20)22(33)25(35)32-11-9-31(10-12-32)24(34)15-5-3-2-4-6-15/h2-8,13-14,28H,9-12H2,1H3,(H,29,30)