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

Systemtic Name: 2-[(3-fluoranyl-4-nitro-phenyl)-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate Openeye Name: 2-[3-fluoro-N-(2-methylsulfonyloxyethyl)-4-nitro-anilino]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[3-fluoro-N-(2-methylsulfonyloxyethyl)-4-nitroanilino]ethyl ester IUPAC Name: 2-[3-fluoro-N-(2-methylsulfonyloxyethyl)-4-nitroanilino]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[3-fluoro-N-(2-methylsulfonyloxyethyl)-4-nitro-anilino]ethyl ester Formula: C12H17FN2O8S2 MolecularWeight: 400.400383

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCN(CCOS(=O)(=O)C)C1=CC(=C(C=C1)[N+](=O)[O-])F

Isomeric SMILES

CS(=O)(=O)OCCN(CCOS(=O)(=O)C)C1=CC(=C(C=C1)[N+](=O)[O-])F

InChI

InChI=1S/C12H17FN2O8S2/c1-24(18,19)22-7-5-14(6-8-23-25(2,20)21)10-3-4-12(15(16)17)11(13)9-10/h3-4,9H,5-8H2,1-2H3