2-[cyclohexylcarbamoyl(nitroso)amino]ethyl 4-bromanylbenzenesulfonate

Systemtic Name: 2-[cyclohexylcarbamoyl(nitroso)amino]ethyl 4-bromanylbenzenesulfonate Openeye Name: 2-[cyclohexylcarbamoyl(nitroso)amino]ethyl 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid 2-[[(cyclohexylamino)-oxomethyl]-nitrosoamino]ethyl ester IUPAC Name: 2-[cyclohexylcarbamoyl(nitroso)amino]ethyl 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid 2-[cyclohexylcarbamoyl(nitroso)amino]ethyl ester Formula: C15H20BrN3O5S MolecularWeight: 434.3054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N(CCOS(=O)(=O)C2=CC=C(C=C2)Br)N=O

Isomeric SMILES

C1CCC(CC1)NC(=O)N(CCOS(=O)(=O)C2=CC=C(C=C2)Br)N=O

InChI

InChI=1S/C15H20BrN3O5S/c16-12-6-8-14(9-7-12)25(22,23)24-11-10-19(18-21)15(20)17-13-4-2-1-3-5-13/h6-9,13H,1-5,10-11H2,(H,17,20)