(2R,4R)-4-oxidanyl-N-[(1S)-1-phenylethyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R,4R)-4-oxidanyl-N-[(1S)-1-phenylethyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R,4R)-4-hydroxy-N-[(1S)-1-phenylethyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2R,4R)-4-hydroxy-N-[(1S)-1-phenylethyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R,4R)-4-hydroxy-N-[(1S)-1-phenylethyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R,4R)-4-hydroxy-N-[(1S)-1-phenylethyl]pyrrolidin-1-ium-2-carboxamide Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2CC(C[NH2+]2)O

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O2/c1-9(10-5-3-2-4-6-10)15-13(17)12-7-11(16)8-14-12/h2-6,9,11-12,14,16H,7-8H2,1H3,(H,15,17)/p+1/t9-,11+,12+/m0/s1