2-[[4-[(3-bromophenyl)iminomethyl]-3-methyl-phenyl]-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate

Systemtic Name: 2-[[4-[(3-bromophenyl)iminomethyl]-3-methyl-phenyl]-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate Openeye Name: 2-[4-[(3-bromophenyl)iminomethyl]-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[4-[(3-bromophenyl)iminomethyl]-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl ester IUPAC Name: 2-[4-[(3-bromophenyl)iminomethyl]-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[4-[(3-bromophenyl)iminomethyl]-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl ester Formula: C20H25BrN2O6S2 MolecularWeight: 533.4563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CCOS(=O)(=O)C)CCOS(=O)(=O)C)C=NC2=CC(=CC=C2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N(CCOS(=O)(=O)C)CCOS(=O)(=O)C)C=NC2=CC(=CC=C2)Br

InChI

InChI=1S/C20H25BrN2O6S2/c1-16-13-20(8-7-17(16)15-22-19-6-4-5-18(21)14-19)23(9-11-28-30(2,24)25)10-12-29-31(3,26)27/h4-8,13-15H,9-12H2,1-3H3