2-[2-methylsulfonyloxyethyl-(4-nitrophenyl)amino]ethyl methanesulfonate

Systemtic Name: 2-[2-methylsulfonyloxyethyl-(4-nitrophenyl)amino]ethyl methanesulfonate Openeye Name: 2-[N-(2-methylsulfonyloxyethyl)-4-nitro-anilino]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[N-(2-methylsulfonyloxyethyl)-4-nitroanilino]ethyl ester IUPAC Name: 2-[N-(2-methylsulfonyloxyethyl)-4-nitroanilino]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[N-(2-methylsulfonyloxyethyl)-4-nitro-anilino]ethyl ester Formula: C12H18N2O8S2 MolecularWeight: 382.40992

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)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O8S2/c1-23(17,18)21-9-7-13(8-10-22-24(2,19)20)11-3-5-12(6-4-11)14(15)16/h3-6H,7-10H2,1-2H3