3-[2-(hydroxymethyl)pyrrolidin-1-yl]-2,5-dimethoxy-1-(6-oxidanylidenehexanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 3-[2-(hydroxymethyl)pyrrolidin-1-yl]-2,5-dimethoxy-1-(6-oxidanylidenehexanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 3-[2-(hydroxymethyl)pyrrolidin-1-yl]-2,5-dimethoxy-1-(6-oxohexanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(1,6-dioxohexyl)-3-[2-(hydroxymethyl)-1-pyrrolidinyl]-2,5-dimethoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 3-[2-(hydroxymethyl)pyrrolidin-1-yl]-2,5-dimethoxy-1-(6-oxohexanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(6-ketohexanoyl)-2,5-dimethoxy-3-(2-methylolpyrrolidino)proline Formula: C18H30N2O7 MolecularWeight: 386.44

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(C(N1C(=O)CCCCC=O)(C(=O)O)OC)N2CCCC2CO

Isomeric SMILES

COC1CC(C(N1C(=O)CCCCC=O)(C(=O)O)OC)N2CCCC2CO

InChI

InChI=1S/C18H30N2O7/c1-26-16-11-14(19-9-6-7-13(19)12-22)18(27-2,17(24)25)20(16)15(23)8-4-3-5-10-21/h10,13-14,16,22H,3-9,11-12H2,1-2H3,(H,24,25)