2-isocyanato-1-[2-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine

Systemtic Name: 2-isocyanato-1-[2-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine Openeye Name: 2-isocyanato-1-[2-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine CAS Name: 2-isocyanato-1-[2-(trifluoromethyl)phenyl]sulfonylpyrrolidine IUPAC Name: 2-isocyanato-1-[2-(trifluoromethyl)phenyl]sulfonylpyrrolidine Traditional Name: 2-isocyanato-1-[2-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine Formula: C12H11F3N2O3S MolecularWeight: 320.28755

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F)N=C=O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F)N=C=O

InChI

InChI=1S/C12H11F3N2O3S/c13-12(14,15)9-4-1-2-5-10(9)21(19,20)17-7-3-6-11(17)16-8-18/h1-2,4-5,11H,3,6-7H2