(5S)-2,2,3-trimethyl-5-(phenylmethyl)imidazolidin-1-ium-4-one chloride

Systemtic Name: (5S)-2,2,3-trimethyl-5-(phenylmethyl)imidazolidin-1-ium-4-one chloride Openeye Name: (5S)-5-benzyl-2,2,3-trimethyl-imidazolidin-1-ium-4-one chloride CAS Name: (5S)-2,2,3-trimethyl-5-(phenylmethyl)-4-imidazolidin-1-iumone chloride IUPAC Name: (5S)-5-benzyl-2,2,3-trimethylimidazolidin-1-ium-4-one chloride Traditional Name: (5S)-5-benzyl-2,2,3-trimethyl-imidazolidin-1-ium-4-one chloride Formula: C13H19ClN2O MolecularWeight: 254.75576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1([NH2+]C(C(=O)N1C)CC2=CC=CC=C2)C.[Cl-]

Isomeric SMILES

CC1([NH2+][C@H](C(=O)N1C)CC2=CC=CC=C2)C.[Cl-]

InChI

InChI=1S/C13H18N2O.ClH/c1-13(2)14-11(12(16)15(13)3)9-10-7-5-4-6-8-10;/h4-8,11,14H,9H2,1-3H3;1H/t11-;/m0./s1