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

Systemtic Name: 2-[[4-[(3-acetamidophenyl)iminomethyl]-3-methyl-phenyl]-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate Openeye Name: 2-[4-[(3-acetamidophenyl)iminomethyl]-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[4-[(3-acetamidophenyl)iminomethyl]-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl ester IUPAC Name: 2-[4-[(3-acetamidophenyl)iminomethyl]-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[4-[(3-acetamidophenyl)iminomethyl]-3-methyl-N-(2-methylsulfonyloxyethyl)anilino]ethyl ester Formula: C22H29N3O7S2 MolecularWeight: 511.61156

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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)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O7S2/c1-17-14-22(25(10-12-31-33(3,27)28)11-13-32-34(4,29)30)9-8-19(17)16-23-20-6-5-7-21(15-20)24-18(2)26/h5-9,14-16H,10-13H2,1-4H3,(H,24,26)