4-isocyanato-1-methyl-2-(trifluoromethyl)benzene

Systemtic Name: 4-isocyanato-1-methyl-2-(trifluoromethyl)benzene Openeye Name: 4-isocyanato-1-methyl-2-(trifluoromethyl)benzene CAS Name: 4-isocyanato-1-methyl-2-(trifluoromethyl)benzene IUPAC Name: 4-isocyanato-1-methyl-2-(trifluoromethyl)benzene Traditional Name: 4-isocyanato-1-methyl-2-(trifluoromethyl)benzene Formula: C9H6F3NO MolecularWeight: 201.14525

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=C=O)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)N=C=O)C(F)(F)F

InChI

InChI=1S/C9H6F3NO/c1-6-2-3-7(13-5-14)4-8(6)9(10,11)12/h2-4H,1H3