3-(6-azanyl-1-methyl-indol-3-yl)-4-(6-fluoranyl-1-methyl-indol-3-yl)pyrrole-2,5-dione hydrochloride

Systemtic Name: 3-(6-azanyl-1-methyl-indol-3-yl)-4-(6-fluoranyl-1-methyl-indol-3-yl)pyrrole-2,5-dione hydrochloride Openeye Name: 3-(6-amino-1-methyl-indol-3-yl)-4-(6-fluoro-1-methyl-indol-3-yl)pyrrole-2,5-dione hydrochloride CAS Name: 3-(6-amino-1-methyl-3-indolyl)-4-(6-fluoro-1-methyl-3-indolyl)pyrrole-2,5-dione hydrochloride IUPAC Name: 3-(6-amino-1-methylindol-3-yl)-4-(6-fluoro-1-methylindol-3-yl)pyrrole-2,5-dione hydrochloride Traditional Name: 3-(6-amino-1-methyl-indol-3-yl)-4-(6-fluoro-1-methyl-indol-3-yl)-3-pyrroline-2,5-quinone hydrochloride Formula: C22H18ClFN4O2 MolecularWeight: 424.855323

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=C(C=C2)N)C3=C(C(=O)NC3=O)C4=CN(C5=C4C=CC(=C5)F)C.Cl

Isomeric SMILES

CN1C=C(C2=C1C=C(C=C2)N)C3=C(C(=O)NC3=O)C4=CN(C5=C4C=CC(=C5)F)C.Cl

InChI

InChI=1S/C22H17FN4O2.ClH/c1-26-9-15(13-5-3-11(23)7-17(13)26)19-20(22(29)25-21(19)28)16-10-27(2)18-8-12(24)4-6-14(16)18;/h3-10H,24H2,1-2H3,(H,25,28,29);1H