(2R,4S)-4-oxidanyl-N-(3,4,5-trimethoxyphenyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R,4S)-4-oxidanyl-N-(3,4,5-trimethoxyphenyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R,4S)-4-hydroxy-N-(3,4,5-trimethoxyphenyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2R,4S)-4-hydroxy-N-(3,4,5-trimethoxyphenyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R,4S)-4-hydroxy-N-(3,4,5-trimethoxyphenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R,4S)-4-hydroxy-N-(3,4,5-trimethoxyphenyl)pyrrolidin-1-ium-2-carboxamide Formula: C14H21N2O5+ MolecularWeight: 297.32694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2CC(C[NH2+]2)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)[C@H]2C[C@@H](C[NH2+]2)O

InChI

InChI=1S/C14H20N2O5/c1-19-11-4-8(5-12(20-2)13(11)21-3)16-14(18)10-6-9(17)7-15-10/h4-5,9-10,15,17H,6-7H2,1-3H3,(H,16,18)/p+1/t9-,10+/m0/s1