1-isocyanato-4-nitro-benzene; 1-isocyanato-4-(trifluoromethyl)benzene

Systemtic Name: 1-isocyanato-4-nitro-benzene; 1-isocyanato-4-(trifluoromethyl)benzene Openeye Name: 1-isocyanato-4-nitro-benzene; 1-isocyanato-4-(trifluoromethyl)benzene CAS Name: 1-isocyanato-4-nitrobenzene; 1-isocyanato-4-(trifluoromethyl)benzene IUPAC Name: 1-isocyanato-4-nitrobenzene; 1-isocyanato-4-(trifluoromethyl)benzene Traditional Name: 1-isocyanato-4-nitro-benzene; 1-isocyanato-4-(trifluoromethyl)benzene Formula: C15H8F3N3O4 MolecularWeight: 351.23693

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)N=C=O.C1=CC(=CC=C1N=C=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)N=C=O.C1=CC(=CC=C1N=C=O)[N+](=O)[O-]

InChI

InChI=1S/C8H4F3NO.C7H4N2O3/c9-8(10,11)6-1-3-7(4-2-6)12-5-13;10-5-8-6-1-3-7(4-2-6)9(11)12/h1-4H;1-4H