1-[2,4-bis(fluoranyl)phenyl]sulfonyl-4-isocyanato-piperidine

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]sulfonyl-4-isocyanato-piperidine Openeye Name: 1-(2,4-difluorophenyl)sulfonyl-4-isocyanato-piperidine CAS Name: 1-(2,4-difluorophenyl)sulfonyl-4-isocyanatopiperidine IUPAC Name: 1-(2,4-difluorophenyl)sulfonyl-4-isocyanatopiperidine Traditional Name: 1-(2,4-difluorophenyl)sulfonyl-4-isocyanato-piperidine Formula: C12H12F2N2O3S MolecularWeight: 302.297086

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N=C=O)S(=O)(=O)C2=C(C=C(C=C2)F)F

Isomeric SMILES

C1CN(CCC1N=C=O)S(=O)(=O)C2=C(C=C(C=C2)F)F

InChI

InChI=1S/C12H12F2N2O3S/c13-9-1-2-12(11(14)7-9)20(18,19)16-5-3-10(4-6-16)15-8-17/h1-2,7,10H,3-6H2