1-butyl-2-(hydroxymethyl)pyrrolidine-3,4-diol; ethanoic acid

Systemtic Name: 1-butyl-2-(hydroxymethyl)pyrrolidine-3,4-diol; ethanoic acid Openeye Name: acetic acid; 1-butyl-2-(hydroxymethyl)pyrrolidine-3,4-diol CAS Name: acetic acid; 1-butyl-2-(hydroxymethyl)pyrrolidine-3,4-diol IUPAC Name: acetic acid; 1-butyl-2-(hydroxymethyl)pyrrolidine-3,4-diol Traditional Name: acetic acid; 1-butyl-2-methylol-pyrrolidine-3,4-diol Formula: C15H31NO9 MolecularWeight: 369.40794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(C(C1CO)O)O.CC(=O)O.CC(=O)O.CC(=O)O

Isomeric SMILES

CCCCN1CC(C(C1CO)O)O.CC(=O)O.CC(=O)O.CC(=O)O

InChI

InChI=1S/C9H19NO3.3C2H4O2/c1-2-3-4-10-5-8(12)9(13)7(10)6-11;3*1-2(3)4/h7-9,11-13H,2-6H2,1H3;3*1H3,(H,3,4)