2-[(3-fluoranyl-4-nitroso-phenyl)-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate

Systemtic Name: 2-[(3-fluoranyl-4-nitroso-phenyl)-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate Openeye Name: 2-[3-fluoro-N-(2-methylsulfonyloxyethyl)-4-nitroso-anilino]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[3-fluoro-N-(2-methylsulfonyloxyethyl)-4-nitrosoanilino]ethyl ester IUPAC Name: 2-[3-fluoro-N-(2-methylsulfonyloxyethyl)-4-nitrosoanilino]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[3-fluoro-N-(2-methylsulfonyloxyethyl)-4-nitroso-anilino]ethyl ester Formula: C12H17FN2O7S2 MolecularWeight: 384.400983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCN(CCOS(=O)(=O)C)C1=CC(=C(C=C1)N=O)F

Isomeric SMILES

CS(=O)(=O)OCCN(CCOS(=O)(=O)C)C1=CC(=C(C=C1)N=O)F

InChI

InChI=1S/C12H17FN2O7S2/c1-23(17,18)21-7-5-15(6-8-22-24(2,19)20)10-3-4-12(14-16)11(13)9-10/h3-4,9H,5-8H2,1-2H3