[2-(2-cyanoethylcarbamoyl)-3-methyl-3,4-dihydro-2H-pyrrol-5-yl]azanium chloride

Systemtic Name: [2-(2-cyanoethylcarbamoyl)-3-methyl-3,4-dihydro-2H-pyrrol-5-yl]azanium chloride Openeye Name: [2-(2-cyanoethylcarbamoyl)-3-methyl-3,4-dihydro-2H-pyrrol-5-yl]ammonium chloride CAS Name: [2-[(2-cyanoethylamino)-oxomethyl]-3-methyl-3,4-dihydro-2H-pyrrol-5-yl]ammonium chloride IUPAC Name: [2-(2-cyanoethylcarbamoyl)-3-methyl-3,4-dihydro-2H-pyrrol-5-yl]azanium chloride Traditional Name: [5-(2-cyanoethylcarbamoyl)-4-methyl-1-pyrrolin-2-yl]ammonium chloride Formula: C9H15ClN4O MolecularWeight: 230.6946

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=NC1C(=O)NCCC#N)[NH3+].[Cl-]

Isomeric SMILES

CC1CC(=NC1C(=O)NCCC#N)[NH3+].[Cl-]

InChI

InChI=1S/C9H14N4O.ClH/c1-6-5-7(11)13-8(6)9(14)12-4-2-3-10;/h6,8H,2,4-5H2,1H3,(H2,11,13)(H,12,14);1H