5-fluoranyl-1-[[4-(2-methylphenyl)piperazin-1-yl]methyl]indole-2,3-dione

Systemtic Name: 5-fluoranyl-1-[[4-(2-methylphenyl)piperazin-1-yl]methyl]indole-2,3-dione Openeye Name: 5-fluoro-1-[[4-(o-tolyl)piperazin-1-yl]methyl]indoline-2,3-dione CAS Name: 5-fluoro-1-[[4-(2-methylphenyl)-1-piperazinyl]methyl]indole-2,3-dione IUPAC Name: 5-fluoro-1-[[4-(2-methylphenyl)piperazin-1-yl]methyl]indole-2,3-dione Traditional Name: 5-fluoro-1-[[4-(o-tolyl)piperazino]methyl]isatin Formula: C20H20FN3O2 MolecularWeight: 353.390103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CN3C4=C(C=C(C=C4)F)C(=O)C3=O

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CN3C4=C(C=C(C=C4)F)C(=O)C3=O

InChI

InChI=1S/C20H20FN3O2/c1-14-4-2-3-5-17(14)23-10-8-22(9-11-23)13-24-18-7-6-15(21)12-16(18)19(25)20(24)26/h2-7,12H,8-11,13H2,1H3