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

Systemtic Name: (2R,4S)-N-[(4-methoxyphenyl)methyl]-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R,4S)-4-hydroxy-N-[(4-methoxyphenyl)methyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2R,4S)-4-hydroxy-N-[(4-methoxyphenyl)methyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R,4S)-4-hydroxy-N-[(4-methoxyphenyl)methyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R,4S)-4-hydroxy-N-p-anisyl-pyrrolidin-1-ium-2-carboxamide Formula: C13H19N2O3+ MolecularWeight: 251.30156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2CC(C[NH2+]2)O

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)[C@H]2C[C@@H](C[NH2+]2)O

InChI

InChI=1S/C13H18N2O3/c1-18-11-4-2-9(3-5-11)7-15-13(17)12-6-10(16)8-14-12/h2-5,10,12,14,16H,6-8H2,1H3,(H,15,17)/p+1/t10-,12+/m0/s1