2-chloroethyl(trimethyl)azanium; 3-(2,6-diethylphenyl)imidazole-4-carboxylate

Systemtic Name: 2-chloroethyl(trimethyl)azanium; 3-(2,6-diethylphenyl)imidazole-4-carboxylate Openeye Name: 2-chloroethyl(trimethyl)ammonium; 3-(2,6-diethylphenyl)imidazole-4-carboxylate CAS Name: 2-chloroethyl(trimethyl)ammonium; 3-(2,6-diethylphenyl)-4-imidazolecarboxylate IUPAC Name: 2-chloroethyl(trimethyl)azanium; 3-(2,6-diethylphenyl)imidazole-4-carboxylate Traditional Name: 2-chloroethyl(trimethyl)ammonium; 3-(2,6-diethylphenyl)imidazole-4-carboxylate Formula: C19H28ClN3O2 MolecularWeight: 365.89752

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2C=NC=C2C(=O)[O-].C[N+](C)(C)CCCl

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2C=NC=C2C(=O)[O-].C[N+](C)(C)CCCl

InChI

InChI=1S/C14H16N2O2.C5H13ClN/c1-3-10-6-5-7-11(4-2)13(10)16-9-15-8-12(16)14(17)18;1-7(2,3)5-4-6/h5-9H,3-4H2,1-2H3,(H,17,18);4-5H2,1-3H3/q;+1/p-1