sodium 2-(methylamino)-3-oxidanylidene-hexadecanoic acid

Systemtic Name: sodium 2-(methylamino)-3-oxidanylidene-hexadecanoic acid Openeye Name: sodium 2-(methylamino)-3-oxo-hexadecanoic acid CAS Name: sodium 2-(methylamino)-3-oxohexadecanoic acid IUPAC Name: sodium 2-(methylamino)-3-oxohexadecanoic acid Traditional Name: sodium 3-keto-2-(methylamino)palmitic acid Formula: C17H33NNaO3+ MolecularWeight: 322.43859

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)C(C(=O)O)NC.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCC(=O)C(C(=O)O)NC.[Na+]

InChI

InChI=1S/C17H33NO3.Na/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(19)16(18-2)17(20)21;/h16,18H,3-14H2,1-2H3,(H,20,21);/q;+1