(2S)-N-(4-ethanoylphenyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-(4-ethanoylphenyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-N-(4-acetylphenyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-N-(4-acetylphenyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-N-(4-acetylphenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-N-(4-acetylphenyl)pyrrolidin-1-ium-2-carboxamide Formula: C13H17N2O2+ MolecularWeight: 233.28628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O2/c1-9(16)10-4-6-11(7-5-10)15-13(17)12-3-2-8-14-12/h4-7,12,14H,2-3,8H2,1H3,(H,15,17)/p+1/t12-/m0/s1