2,2-bis(2-methyl-2-nitro-propyl)butanedioate

Systemtic Name: 2,2-bis(2-methyl-2-nitro-propyl)butanedioate Openeye Name: 2,2-bis(2-methyl-2-nitro-propyl)butanedioate CAS Name: 2,2-bis(2-methyl-2-nitropropyl)butanedioate IUPAC Name: 2,2-bis(2-methyl-2-nitropropyl)butanedioate Traditional Name: 2,2-bis(2-methyl-2-nitro-propyl)succinate Formula: C12H18N2O8-2 MolecularWeight: 318.27992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CC(=O)[O-])(CC(C)(C)[N+](=O)[O-])C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(CC(CC(=O)[O-])(CC(C)(C)[N+](=O)[O-])C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H20N2O8/c1-10(2,13(19)20)6-12(9(17)18,5-8(15)16)7-11(3,4)14(21)22/h5-7H2,1-4H3,(H,15,16)(H,17,18)/p-2