(3S)-1-[(2R,4R)-4-oxidanylpyrrolidin-1-ium-2-yl]carbonylpiperidine-3-carboxamide

Systemtic Name: (3S)-1-[(2R,4R)-4-oxidanylpyrrolidin-1-ium-2-yl]carbonylpiperidine-3-carboxamide Openeye Name: (3S)-1-[(2R,4R)-4-hydroxypyrrolidin-1-ium-2-carbonyl]piperidine-3-carboxamide CAS Name: (3S)-1-[[(2R,4R)-4-hydroxy-2-pyrrolidin-1-iumyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(2R,4R)-4-hydroxypyrrolidin-1-ium-2-carbonyl]piperidine-3-carboxamide Traditional Name: (3S)-1-[(2R,4R)-4-hydroxypyrrolidin-1-ium-2-carbonyl]nipecotamide Formula: C11H20N3O3+ MolecularWeight: 242.2948

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2CC(C[NH2+]2)O)C(=O)N

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)[C@H]2C[C@H](C[NH2+]2)O)C(=O)N

InChI

InChI=1S/C11H19N3O3/c12-10(16)7-2-1-3-14(6-7)11(17)9-4-8(15)5-13-9/h7-9,13,15H,1-6H2,(H2,12,16)/p+1/t7-,8+,9+/m0/s1