2-tert-butyl-5-[[1-[(4-fluorophenyl)methyl]indol-3-yl]methylidene]-2-methyl-1,3-dioxane-4,6-dione

Systemtic Name: 2-tert-butyl-5-[[1-[(4-fluorophenyl)methyl]indol-3-yl]methylidene]-2-methyl-1,3-dioxane-4,6-dione Openeye Name: 2-tert-butyl-5-[[1-[(4-fluorophenyl)methyl]indol-3-yl]methylene]-2-methyl-1,3-dioxane-4,6-dione CAS Name: 2-tert-butyl-5-[[1-[(4-fluorophenyl)methyl]-3-indolyl]methylidene]-2-methyl-1,3-dioxane-4,6-dione IUPAC Name: 2-tert-butyl-5-[[1-[(4-fluorophenyl)methyl]indol-3-yl]methylidene]-2-methyl-1,3-dioxane-4,6-dione Traditional Name: 2-tert-butyl-5-[[1-(4-fluorobenzyl)indol-3-yl]methylene]-2-methyl-1,3-dioxane-4,6-quinone Formula: C25H24FNO4 MolecularWeight: 421.460763

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)F)C(=O)O1)C(C)(C)C

Isomeric SMILES

CC1(OC(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)F)C(=O)O1)C(C)(C)C

InChI

InChI=1S/C25H24FNO4/c1-24(2,3)25(4)30-22(28)20(23(29)31-25)13-17-15-27(21-8-6-5-7-19(17)21)14-16-9-11-18(26)12-10-16/h5-13,15H,14H2,1-4H3