3-(6-chloranyl-5-fluoranyl-1-methyl-indol-3-yl)-4-[6-(hydroxymethyl)-1-benzofuran-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-(6-chloranyl-5-fluoranyl-1-methyl-indol-3-yl)-4-[6-(hydroxymethyl)-1-benzofuran-3-yl]pyrrole-2,5-dione Openeye Name: 3-(6-chloro-5-fluoro-1-methyl-indol-3-yl)-4-[6-(hydroxymethyl)benzofuran-3-yl]pyrrole-2,5-dione CAS Name: 3-(6-chloro-5-fluoro-1-methyl-3-indolyl)-4-[6-(hydroxymethyl)-3-benzofuranyl]pyrrole-2,5-dione IUPAC Name: 3-(6-chloro-5-fluoro-1-methylindol-3-yl)-4-[6-(hydroxymethyl)-1-benzofuran-3-yl]pyrrole-2,5-dione Traditional Name: 3-(6-chloro-5-fluoro-1-methyl-indol-3-yl)-4-(6-methylolbenzofuran-3-yl)-3-pyrroline-2,5-quinone Formula: C22H14ClFN2O4 MolecularWeight: 424.808963

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC(=C(C=C21)Cl)F)C3=C(C(=O)NC3=O)C4=COC5=C4C=CC(=C5)CO

Isomeric SMILES

CN1C=C(C2=CC(=C(C=C21)Cl)F)C3=C(C(=O)NC3=O)C4=COC5=C4C=CC(=C5)CO

InChI

InChI=1S/C22H14ClFN2O4/c1-26-7-13(12-5-16(24)15(23)6-17(12)26)19-20(22(29)25-21(19)28)14-9-30-18-4-10(8-27)2-3-11(14)18/h2-7,9,27H,8H2,1H3,(H,25,28,29)