4-fluoranyl-2-oxaldehydoyl-N'-oxidanyl-3-[4-(phenylcarbonyl)piperazin-1-yl]-1H-indole-7-carboximidamide

Systemtic Name: 4-fluoranyl-2-oxaldehydoyl-N'-oxidanyl-3-[4-(phenylcarbonyl)piperazin-1-yl]-1H-indole-7-carboximidamide Openeye Name: 3-(4-benzoylpiperazin-1-yl)-4-fluoro-N'-hydroxy-2-oxaldehydoyl-1H-indole-7-carboxamidine CAS Name: 3-(4-benzoyl-1-piperazinyl)-4-fluoro-N'-hydroxy-2-oxaldehydoyl-1H-indole-7-carboximidamide IUPAC Name: 3-(4-benzoylpiperazin-1-yl)-4-fluoro-N'-hydroxy-2-oxaldehydoyl-1H-indole-7-carboximidamide Traditional Name: 3-(4-benzoylpiperazino)-4-fluoro-2-glyoxyloyl-N'-hydroxy-1H-indole-7-carboxamidine Formula: C22H20FN5O4 MolecularWeight: 437.423703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(NC3=C(C=CC(=C32)F)C(=NO)N)C(=O)C=O)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(NC3=C(C=CC(=C32)F)/C(=N\O)/N)C(=O)C=O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20FN5O4/c23-15-7-6-14(21(24)26-32)18-17(15)20(19(25-18)16(30)12-29)27-8-10-28(11-9-27)22(31)13-4-2-1-3-5-13/h1-7,12,25,32H,8-11H2,(H2,24,26)