bis(oxidanyl)-oxidanylidene-azanium; 3-[[5-(2-cyanoethylamino)-2,5-dimethyl-hexan-2-yl]amino]propanenitrile

Systemtic Name: bis(oxidanyl)-oxidanylidene-azanium; 3-[[5-(2-cyanoethylamino)-2,5-dimethyl-hexan-2-yl]amino]propanenitrile Openeye Name: 3-[[4-(2-cyanoethylamino)-1,1,4-trimethyl-pentyl]amino]propanenitrile; dihydroxy(oxo)ammonium CAS Name: 3-[[5-(2-cyanoethylamino)-2,5-dimethylhexan-2-yl]amino]propanenitrile; dihydroxy(oxo)ammonium IUPAC Name: 3-[[5-(2-cyanoethylamino)-2,5-dimethylhexan-2-yl]amino]propanenitrile; dihydroxy(oxo)azanium Traditional Name: 3-[[4-(2-cyanoethylamino)-1,1,4-trimethyl-pentyl]amino]propionitrile; dihydroxy(keto)ammonium Formula: C14H28N5O3+ MolecularWeight: 314.40382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(C)(C)NCCC#N)NCCC#N.[N+](=O)(O)O

Isomeric SMILES

CC(C)(CCC(C)(C)NCCC#N)NCCC#N.[N+](=O)(O)O

InChI

InChI=1S/C14H26N4.H2NO3/c1-13(2,17-11-5-9-15)7-8-14(3,4)18-12-6-10-16;2-1(3)4/h17-18H,5-8,11-12H2,1-4H3;(H2,2,3,4)/q;+1