2-hydroxyethyl(trimethyl)azanium; (E)-3-(1H-imidazol-5-yl)prop-2-enoate; dihydrochloride

Systemtic Name: 2-hydroxyethyl(trimethyl)azanium; (E)-3-(1H-imidazol-5-yl)prop-2-enoate; dihydrochloride Openeye Name: 2-hydroxyethyl(trimethyl)ammonium; (E)-3-(1H-imidazol-5-yl)prop-2-enoate; dihydrochloride CAS Name: 2-hydroxyethyl(trimethyl)ammonium; (E)-3-(1H-imidazol-5-yl)-2-propenoate; dihydrochloride IUPAC Name: 2-hydroxyethyl(trimethyl)azanium; (E)-3-(1H-imidazol-5-yl)prop-2-enoate; dihydrochloride Traditional Name: 2-hydroxyethyl(trimethyl)ammonium; (E)-3-(1H-imidazol-5-yl)acrylate; dihydrochloride Formula: C11H21Cl2N3O3 MolecularWeight: 314.20874

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCO.C1=C(NC=N1)C=CC(=O)[O-].Cl.Cl

Isomeric SMILES

C[N+](C)(C)CCO.C1=C(NC=N1)/C=C/C(=O)[O-].Cl.Cl

InChI

InChI=1S/C6H6N2O2.C5H14NO.2ClH/c9-6(10)2-1-5-3-7-4-8-5;1-6(2,3)4-5-7;;/h1-4H,(H,7,8)(H,9,10);7H,4-5H2,1-3H3;2*1H/q;+1;;/p-1/b2-1+;;;