(2S)-N-(2,6-dimethylphenyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-(2,6-dimethylphenyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-N-(2,6-dimethylphenyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-N-(2,6-dimethylphenyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-N-(2,6-dimethylphenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-N-(2,6-dimethylphenyl)pyrrolidin-1-ium-2-carboxamide Formula: C13H19N2O+ MolecularWeight: 219.30276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2CCC[NH2+]2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)[C@@H]2CCC[NH2+]2

InChI

InChI=1S/C13H18N2O/c1-9-5-3-6-10(2)12(9)15-13(16)11-7-4-8-14-11/h3,5-6,11,14H,4,7-8H2,1-2H3,(H,15,16)/p+1/t11-/m0/s1