2,2-dimethyl-5,5-bis[(4-nitrophenyl)methyl]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5,5-bis[(4-nitrophenyl)methyl]-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5,5-bis[(4-nitrophenyl)methyl]-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5,5-bis[(4-nitrophenyl)methyl]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5,5-bis[(4-nitrophenyl)methyl]-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5,5-bis(4-nitrobenzyl)-1,3-dioxane-4,6-quinone Formula: C20H18N2O8 MolecularWeight: 414.36552

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)(CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)(CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H18N2O8/c1-19(2)29-17(23)20(18(24)30-19,11-13-3-7-15(8-4-13)21(25)26)12-14-5-9-16(10-6-14)22(27)28/h3-10H,11-12H2,1-2H3