3-(dimethylamino)propanamide; docosanoic acid; 2-oxidanylbutanedioic acid

Systemtic Name: 3-(dimethylamino)propanamide; docosanoic acid; 2-oxidanylbutanedioic acid Openeye Name: 3-(dimethylamino)propanamide; docosanoic acid; 2-hydroxybutanedioic acid CAS Name: 3-(dimethylamino)propanamide; docosanoic acid; 2-hydroxybutanedioic acid IUPAC Name: 3-(dimethylamino)propanamide; docosanoic acid; 2-hydroxybutanedioic acid Traditional Name: behenic acid; 3-(dimethylamino)propionamide; malic acid Formula: C31H62N2O8 MolecularWeight: 590.83258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)O.CN(C)CCC(=O)N.C(C(C(=O)O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)O.CN(C)CCC(=O)N.C(C(C(=O)O)O)C(=O)O

InChI

InChI=1S/C22H44O2.C5H12N2O.C4H6O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24;1-7(2)4-3-5(6)8;5-2(4(8)9)1-3(6)7/h2-21H2,1H3,(H,23,24);3-4H2,1-2H3,(H2,6,8);2,5H,1H2,(H,6,7)(H,8,9)