(2S)-1-methyl-1-(2-methylphenyl)pyrrolidin-1-ium-2-carboxylic acid

Systemtic Name: (2S)-1-methyl-1-(2-methylphenyl)pyrrolidin-1-ium-2-carboxylic acid Openeye Name: (2S)-1-methyl-1-(o-tolyl)pyrrolidin-1-ium-2-carboxylic acid CAS Name: (2S)-1-methyl-1-(2-methylphenyl)-2-pyrrolidin-1-iumcarboxylic acid IUPAC Name: (2S)-1-methyl-1-(2-methylphenyl)pyrrolidin-1-ium-2-carboxylic acid Traditional Name: (2S)-1-methyl-1-(o-tolyl)pyrrolidin-1-ium-2-carboxylic acid Formula: C13H18NO2+ MolecularWeight: 220.28752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1[N+]2(CCCC2C(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO2/c1-10-6-3-4-7-11(10)14(2)9-5-8-12(14)13(15)16/h3-4,6-7,12H,5,8-9H2,1-2H3/p+1/t12-,14?/m0/s1