1-isocyanatooctadecane; 1,1,1-tris(fluoranyl)-2-isocyanato-ethane

Systemtic Name: 1-isocyanatooctadecane; 1,1,1-tris(fluoranyl)-2-isocyanato-ethane Openeye Name: 1-isocyanatooctadecane; 1,1,1-trifluoro-2-isocyanato-ethane CAS Name: 1-isocyanatooctadecane; 1,1,1-trifluoro-2-isocyanatoethane IUPAC Name: 1-isocyanatooctadecane; 1,1,1-trifluoro-2-isocyanatoethane Traditional Name: 1-isocyanatooctadecane; 1,1,1-trifluoro-2-isocyanato-ethane Formula: C22H39F3N2O2 MolecularWeight: 420.55247

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN=C=O.C(C(F)(F)F)N=C=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN=C=O.C(C(F)(F)F)N=C=O

InChI

InChI=1S/C19H37NO.C3H2F3NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19-21;4-3(5,6)1-7-2-8/h2-18H2,1H3;1H2