1-(3-bromophenyl)sulfonyl-4-isocyanato-piperidine

Systemtic Name: 1-(3-bromophenyl)sulfonyl-4-isocyanato-piperidine Openeye Name: 1-(3-bromophenyl)sulfonyl-4-isocyanato-piperidine CAS Name: 1-(3-bromophenyl)sulfonyl-4-isocyanatopiperidine IUPAC Name: 1-(3-bromophenyl)sulfonyl-4-isocyanatopiperidine Traditional Name: 1-(3-bromophenyl)sulfonyl-4-isocyanato-piperidine Formula: C12H13BrN2O3S MolecularWeight: 345.21222

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N=C=O)S(=O)(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

C1CN(CCC1N=C=O)S(=O)(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C12H13BrN2O3S/c13-10-2-1-3-12(8-10)19(17,18)15-6-4-11(5-7-15)14-9-16/h1-3,8,11H,4-7H2