2-hydroxyethyl(trimethyl)azanium; 2-(4-nitrophenyl)ethanamine; carbamate; chloride

Systemtic Name: 2-hydroxyethyl(trimethyl)azanium; 2-(4-nitrophenyl)ethanamine; carbamate; chloride Openeye Name: 2-hydroxyethyl(trimethyl)ammonium; 2-(4-nitrophenyl)ethanamine; carbamate; chloride CAS Name: 2-hydroxyethyl(trimethyl)ammonium; 2-(4-nitrophenyl)ethanamine; carbamate; chloride IUPAC Name: 2-hydroxyethyl(trimethyl)azanium; 2-(4-nitrophenyl)ethanamine; carbamate; chloride Traditional Name: 2-hydroxyethyl(trimethyl)ammonium; 2-(4-nitrophenyl)ethylamine; carbamate; chloride Formula: C14H26ClN4O5- MolecularWeight: 365.83304

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCO.C1=CC(=CC=C1CCN)[N+](=O)[O-].C(=O)(N)[O-].[Cl-]

Isomeric SMILES

C[N+](C)(C)CCO.C1=CC(=CC=C1CCN)[N+](=O)[O-].C(=O)(N)[O-].[Cl-]

InChI

InChI=1S/C8H10N2O2.C5H14NO.CH3NO2.ClH/c9-6-5-7-1-3-8(4-2-7)10(11)12;1-6(2,3)4-5-7;2-1(3)4;/h1-4H,5-6,9H2;7H,4-5H2,1-3H3;2H2,(H,3,4);1H/q;+1;;/p-2