(2R,4S)-N-(2,5-diethoxyphenyl)-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R,4S)-N-(2,5-diethoxyphenyl)-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R,4S)-N-(2,5-diethoxyphenyl)-4-hydroxy-pyrrolidin-1-ium-2-carboxamide CAS Name: (2R,4S)-N-(2,5-diethoxyphenyl)-4-hydroxy-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R,4S)-N-(2,5-diethoxyphenyl)-4-hydroxypyrrolidin-1-ium-2-carboxamide Traditional Name: (2R,4S)-N-(2,5-diethoxyphenyl)-4-hydroxy-pyrrolidin-1-ium-2-carboxamide Formula: C15H23N2O4+ MolecularWeight: 295.35412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2CC(C[NH2+]2)O

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)[C@H]2C[C@@H](C[NH2+]2)O

InChI

InChI=1S/C15H22N2O4/c1-3-20-11-5-6-14(21-4-2)12(8-11)17-15(19)13-7-10(18)9-16-13/h5-6,8,10,13,16,18H,3-4,7,9H2,1-2H3,(H,17,19)/p+1/t10-,13+/m0/s1