(2S)-1-(4-bromophenyl)sulfonyl-2-isocyanato-piperidine

Systemtic Name: (2S)-1-(4-bromophenyl)sulfonyl-2-isocyanato-piperidine Openeye Name: (2S)-1-(4-bromophenyl)sulfonyl-2-isocyanato-piperidine CAS Name: (2S)-1-(4-bromophenyl)sulfonyl-2-isocyanatopiperidine IUPAC Name: (2S)-1-(4-bromophenyl)sulfonyl-2-isocyanatopiperidine Traditional Name: (2S)-1-brosyl-2-isocyanato-piperidine Formula: C12H13BrN2O3S MolecularWeight: 345.21222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)N=C=O)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1CCN([C@@H](C1)N=C=O)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H13BrN2O3S/c13-10-4-6-11(7-5-10)19(17,18)15-8-2-1-3-12(15)14-9-16/h4-7,12H,1-3,8H2/t12-/m0/s1