[(2S)-4-chloranylbutan-2-yl]-(phenylmethyl)azanium chloride

Systemtic Name: [(2S)-4-chloranylbutan-2-yl]-(phenylmethyl)azanium chloride Openeye Name: benzyl-[(1S)-3-chloro-1-methyl-propyl]ammonium chloride CAS Name: [(2S)-4-chlorobutan-2-yl]-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-[(2S)-4-chlorobutan-2-yl]azanium chloride Traditional Name: benzyl-[(1S)-3-chloro-1-methyl-propyl]ammonium chloride Formula: C11H17Cl2N MolecularWeight: 234.16538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCl)[NH2+]CC1=CC=CC=C1.[Cl-]

Isomeric SMILES

C[C@@H](CCCl)[NH2+]CC1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C11H16ClN.ClH/c1-10(7-8-12)13-9-11-5-3-2-4-6-11;/h2-6,10,13H,7-9H2,1H3;1H/t10-;/m0./s1