[1,1-bis(azaniumyl)-2-(diethylamino)ethyl]azanium; 2-nitropropane

Systemtic Name: [1,1-bis(azaniumyl)-2-(diethylamino)ethyl]azanium; 2-nitropropane Openeye Name: [1,1-bis(azaniumyl)-2-(diethylamino)ethyl]ammonium; 2-nitropropane CAS Name: [1,1-diammonio-2-(diethylamino)ethyl]ammonium; 2-nitropropane IUPAC Name: [1,1-bis(azaniumyl)-2-(diethylamino)ethyl]azanium; 2-nitropropane Traditional Name: [1,1-diammonio-2-(diethylamino)ethyl]ammonium; 2-nitropropane Formula: C15H39N7O6 MolecularWeight: 413.51346

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC([NH3+])([NH3+])[NH3+].C[C-](C)[N+](=O)[O-].C[C-](C)[N+](=O)[O-].C[C-](C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CC([NH3+])([NH3+])[NH3+].C[C-](C)[N+](=O)[O-].C[C-](C)[N+](=O)[O-].C[C-](C)[N+](=O)[O-]

InChI

InChI=1S/C6H18N4.3C3H6NO2/c1-3-10(4-2)5-6(7,8)9;3*1-3(2)4(5)6/h3-5,7-9H2,1-2H3;3*1-2H3/q;3*-1/p+3