N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-4-isocyanato-2-(trifluoromethyl)aniline

Systemtic Name: N-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-4-isocyanato-2-(trifluoromethyl)aniline Openeye Name: N-[(3-chloro-4-fluoro-phenyl)methyl]-4-isocyanato-2-(trifluoromethyl)aniline CAS Name: N-[(3-chloro-4-fluorophenyl)methyl]-4-isocyanato-2-(trifluoromethyl)aniline IUPAC Name: N-[(3-chloro-4-fluorophenyl)methyl]-4-isocyanato-2-(trifluoromethyl)aniline Traditional Name: (3-chloro-4-fluoro-benzyl)-[4-isocyanato-2-(trifluoromethyl)phenyl]amine Formula: C15H9ClF4N2O MolecularWeight: 344.691373

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC2=C(C=C(C=C2)N=C=O)C(F)(F)F)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1CNC2=C(C=C(C=C2)N=C=O)C(F)(F)F)Cl)F

InChI

InChI=1S/C15H9ClF4N2O/c16-12-5-9(1-3-13(12)17)7-21-14-4-2-10(22-8-23)6-11(14)15(18,19)20/h1-6,21H,7H2