1-(2-chlorophenyl)sulfonyl-3-isocyanato-piperidine

Systemtic Name: 1-(2-chlorophenyl)sulfonyl-3-isocyanato-piperidine Openeye Name: 1-(2-chlorophenyl)sulfonyl-3-isocyanato-piperidine CAS Name: 1-(2-chlorophenyl)sulfonyl-3-isocyanatopiperidine IUPAC Name: 1-(2-chlorophenyl)sulfonyl-3-isocyanatopiperidine Traditional Name: 1-(2-chlorophenyl)sulfonyl-3-isocyanato-piperidine Formula: C12H13ClN2O3S MolecularWeight: 300.76122

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2Cl)N=C=O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2Cl)N=C=O

InChI

InChI=1S/C12H13ClN2O3S/c13-11-5-1-2-6-12(11)19(17,18)15-7-3-4-10(8-15)14-9-16/h1-2,5-6,10H,3-4,7-8H2