1-[[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]methyl]-6-methoxy-indole-2,3-dione

Systemtic Name: 1-[[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]methyl]-6-methoxy-indole-2,3-dione Openeye Name: 1-[[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]methyl]-6-methoxy-indoline-2,3-dione CAS Name: 1-[[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]methyl]-6-methoxyindole-2,3-dione IUPAC Name: 1-[[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]methyl]-6-methoxyindole-2,3-dione Traditional Name: 1-[[4-(2-chloro-6-fluoro-benzyl)piperazino]methyl]-6-methoxy-isatin Formula: C21H21ClFN3O3 MolecularWeight: 417.861143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C(=O)N2CN3CCN(CC3)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)C(=O)N2CN3CCN(CC3)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C21H21ClFN3O3/c1-29-14-5-6-15-19(11-14)26(21(28)20(15)27)13-25-9-7-24(8-10-25)12-16-17(22)3-2-4-18(16)23/h2-6,11H,7-10,12-13H2,1H3