5-bromanyl-2,2-dimethyl-5-[(5-nitro-1H-indol-3-yl)methyl]-1,3-dioxane-4,6-dione

Systemtic Name: 5-bromanyl-2,2-dimethyl-5-[(5-nitro-1H-indol-3-yl)methyl]-1,3-dioxane-4,6-dione Openeye Name: 5-bromo-2,2-dimethyl-5-[(5-nitro-1H-indol-3-yl)methyl]-1,3-dioxane-4,6-dione CAS Name: 5-bromo-2,2-dimethyl-5-[(5-nitro-1H-indol-3-yl)methyl]-1,3-dioxane-4,6-dione IUPAC Name: 5-bromo-2,2-dimethyl-5-[(5-nitro-1H-indol-3-yl)methyl]-1,3-dioxane-4,6-dione Traditional Name: 5-bromo-2,2-dimethyl-5-[(5-nitro-1H-indol-3-yl)methyl]-1,3-dioxane-4,6-quinone Formula: C15H13BrN2O6 MolecularWeight: 397.17752

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)(CC2=CNC3=C2C=C(C=C3)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)(CC2=CNC3=C2C=C(C=C3)[N+](=O)[O-])Br)C

InChI

InChI=1S/C15H13BrN2O6/c1-14(2)23-12(19)15(16,13(20)24-14)6-8-7-17-11-4-3-9(18(21)22)5-10(8)11/h3-5,7,17H,6H2,1-2H3