sodium (Z)-[1-octadecyl-5-oxidanylidene-2-(trifluoromethyl)imidazol-4-ylidene]methanolate

Systemtic Name: sodium (Z)-[1-octadecyl-5-oxidanylidene-2-(trifluoromethyl)imidazol-4-ylidene]methanolate Openeye Name: sodium (Z)-[1-octadecyl-5-oxo-2-(trifluoromethyl)imidazol-4-ylidene]methanolate CAS Name: sodium (Z)-[1-octadecyl-5-oxo-2-(trifluoromethyl)-4-imidazolylidene]methanolate IUPAC Name: sodium (Z)-[1-octadecyl-5-oxo-2-(trifluoromethyl)imidazol-4-ylidene]methanolate Traditional Name: sodium (Z)-[5-keto-1-stearyl-2-(trifluoromethyl)-2-imidazolin-4-ylidene]methanolate Formula: C23H38F3N2NaO2 MolecularWeight: 454.545

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C(=O)C(=C[O-])N=C1C(F)(F)F.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C(=O)/C(=C/[O-])/N=C1C(F)(F)F.[Na+]

InChI

InChI=1S/C23H39F3N2O2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-21(30)20(19-29)27-22(28)23(24,25)26;/h19,29H,2-18H2,1H3;/q;+1/p-1/b20-19-;