1-butyl-N,N,3-trimethyl-pyridin-1-ium-4-amine nitrate

Systemtic Name: 1-butyl-N,N,3-trimethyl-pyridin-1-ium-4-amine nitrate Openeye Name: 1-butyl-N,N,3-trimethyl-pyridin-1-ium-4-amine nitrate CAS Name: 1-butyl-N,N,3-trimethyl-4-pyridin-1-iumamine nitrate IUPAC Name: 1-butyl-N,N,3-trimethylpyridin-1-ium-4-amine nitrate Traditional Name: (1-butyl-3-methyl-pyridin-1-ium-4-yl)-dimethyl-amine nitrate Formula: C12H21N3O3 MolecularWeight: 255.31344

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CC(=C(C=C1)N(C)C)C.[N+](=O)([O-])[O-]

Isomeric SMILES

CCCC[N+]1=CC(=C(C=C1)N(C)C)C.[N+](=O)([O-])[O-]

InChI

InChI=1S/C12H21N2.NO3/c1-5-6-8-14-9-7-12(13(3)4)11(2)10-14;2-1(3)4/h7,9-10H,5-6,8H2,1-4H3;/q+1;-1