2-(1H-imidazol-5-yl)ethanamine; methyl pyridine-3-carboxylate; hydrochloride

Systemtic Name: 2-(1H-imidazol-5-yl)ethanamine; methyl pyridine-3-carboxylate; hydrochloride Openeye Name: 2-(1H-imidazol-5-yl)ethanamine; methyl pyridine-3-carboxylate; hydrochloride CAS Name: 2-(1H-imidazol-5-yl)ethanamine; 3-pyridinecarboxylic acid methyl ester; hydrochloride IUPAC Name: 2-(1H-imidazol-5-yl)ethanamine; methyl pyridine-3-carboxylate; hydrochloride Traditional Name: 2-(1H-imidazol-5-yl)ethylamine; nicotinic acid methyl ester; hydrochloride Formula: C12H17ClN4O2 MolecularWeight: 284.74198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=CC=C1.C1=C(NC=N1)CCN.Cl

Isomeric SMILES

COC(=O)C1=CN=CC=C1.C1=C(NC=N1)CCN.Cl

InChI

InChI=1S/C7H7NO2.C5H9N3.ClH/c1-10-7(9)6-3-2-4-8-5-6;6-2-1-5-3-7-4-8-5;/h2-5H,1H3;3-4H,1-2,6H2,(H,7,8);1H