(3S,4S)-3,4-bis(oxidanyl)-N-pentyl-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (3S,4S)-3,4-bis(oxidanyl)-N-pentyl-1-pyridin-3-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: (3S,4S)-3,4-dihydroxy-N-pentyl-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide CAS Name: (3S,4S)-3,4-dihydroxy-1-[oxo(3-pyridinyl)methyl]-N-pentyl-2-pyrrolidinecarboxamide IUPAC Name: (3S,4S)-3,4-dihydroxy-N-pentyl-1-(pyridine-3-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (3S,4S)-N-amyl-3,4-dihydroxy-1-nicotinoyl-pyrrolidine-2-carboxamide Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1C(C(CN1C(=O)C2=CN=CC=C2)O)O

Isomeric SMILES

CCCCCNC(=O)C1[C@@H]([C@H](CN1C(=O)C2=CN=CC=C2)O)O

InChI

InChI=1S/C16H23N3O4/c1-2-3-4-8-18-15(22)13-14(21)12(20)10-19(13)16(23)11-6-5-7-17-9-11/h5-7,9,12-14,20-21H,2-4,8,10H2,1H3,(H,18,22)/t12-,13?,14+/m0/s1