(2S)-1-(2-hydroxyethyl)-N-(2,4,6-trimethylphenyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-(2-hydroxyethyl)-N-(2,4,6-trimethylphenyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-(2-hydroxyethyl)-N-(2,4,6-trimethylphenyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-(2-hydroxyethyl)-N-(2,4,6-trimethylphenyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-(2-hydroxyethyl)-N-(2,4,6-trimethylphenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-(2-hydroxyethyl)-N-mesityl-pyrrolidin-1-ium-2-carboxamide Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O2/c1-11-9-12(2)15(13(3)10-11)17-16(20)14-5-4-6-18(14)7-8-19/h9-10,14,19H,4-8H2,1-3H3,(H,17,20)/p+1/t14-/m0/s1