1,1-bis(2-methyl-2-nitro-propyl)piperidin-1-ium

Systemtic Name: 1,1-bis(2-methyl-2-nitro-propyl)piperidin-1-ium Openeye Name: 1,1-bis(2-methyl-2-nitro-propyl)piperidin-1-ium CAS Name: 1,1-bis(2-methyl-2-nitropropyl)piperidin-1-ium IUPAC Name: 1,1-bis(2-methyl-2-nitropropyl)piperidin-1-ium Traditional Name: 1,1-bis(2-methyl-2-nitro-propyl)piperidin-1-ium Formula: C13H26N3O4+ MolecularWeight: 288.36324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[N+]1(CCCCC1)CC(C)(C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C[N+]1(CCCCC1)CC(C)(C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H26N3O4/c1-12(2,14(17)18)10-16(8-6-5-7-9-16)11-13(3,4)15(19)20/h5-11H2,1-4H3/q+1