1-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-3-isocyanato-piperidine

Systemtic Name: 1-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-3-isocyanato-piperidine Openeye Name: 1-(4-bromo-2-chloro-phenyl)sulfonyl-3-isocyanato-piperidine CAS Name: 1-(4-bromo-2-chlorophenyl)sulfonyl-3-isocyanatopiperidine IUPAC Name: 1-(4-bromo-2-chlorophenyl)sulfonyl-3-isocyanatopiperidine Traditional Name: 1-(4-bromo-2-chloro-phenyl)sulfonyl-3-isocyanato-piperidine Formula: C12H12BrClN2O3S MolecularWeight: 379.65728

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=C(C=C(C=C2)Br)Cl)N=C=O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=C(C=C(C=C2)Br)Cl)N=C=O

InChI

InChI=1S/C12H12BrClN2O3S/c13-9-3-4-12(11(14)6-9)20(18,19)16-5-1-2-10(7-16)15-8-17/h3-4,6,10H,1-2,5,7H2