2-[4,6-bis(fluoranyl)-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]indol-1-yl]-N'-oxidanyl-ethanimidamide

Systemtic Name: 2-[4,6-bis(fluoranyl)-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]indol-1-yl]-N'-oxidanyl-ethanimidamide Openeye Name: 2-[3-[2-(4-benzoylpiperazin-1-yl)-2-oxo-acetyl]-4,6-difluoro-indol-1-yl]-N'-hydroxy-acetamidine CAS Name: 2-[3-[2-(4-benzoyl-1-piperazinyl)-1,2-dioxoethyl]-4,6-difluoro-1-indolyl]-N'-hydroxyethanimidamide IUPAC Name: 2-[3-[2-(4-benzoylpiperazin-1-yl)-2-oxoacetyl]-4,6-difluoroindol-1-yl]-N'-hydroxyethanimidamide Traditional Name: 2-[3-[2-(4-benzoylpiperazino)-2-keto-acetyl]-4,6-difluoro-indol-1-yl]-N'-hydroxy-acetamidine Formula: C23H21F2N5O4 MolecularWeight: 469.440746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C(=O)C3=CN(C4=CC(=CC(=C43)F)F)CC(=NO)N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C(=O)C3=CN(C4=CC(=CC(=C43)F)F)C/C(=N/O)/N

InChI

InChI=1S/C23H21F2N5O4/c24-15-10-17(25)20-16(12-30(18(20)11-15)13-19(26)27-34)21(31)23(33)29-8-6-28(7-9-29)22(32)14-4-2-1-3-5-14/h1-5,10-12,34H,6-9,13H2,(H2,26,27)