2-(methylamino)-3-oxidanylidene-icosanoic acid

Systemtic Name: 2-(methylamino)-3-oxidanylidene-icosanoic acid Openeye Name: 2-(methylamino)-3-oxo-icosanoic acid CAS Name: 2-(methylamino)-3-oxoeicosanoic acid IUPAC Name: 2-(methylamino)-3-oxoicosanoic acid Traditional Name: 3-keto-2-(methylamino)arachidic acid Formula: C21H41NO3 MolecularWeight: 355.55514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C(C(=O)O)NC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C(C(=O)O)NC

InChI

InChI=1S/C21H41NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(23)20(22-2)21(24)25/h20,22H,3-18H2,1-2H3,(H,24,25)