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

Systemtic Name: 2-[(3-methyl-4-phenyldiazenyl-phenyl)-(2-methylsulfonyloxyethyl)amino]ethyl methanesulfonate Openeye Name: 2-[3-methyl-N-(2-methylsulfonyloxyethyl)-4-phenylazo-anilino]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[3-methyl-N-(2-methylsulfonyloxyethyl)-4-phenyldiazenylanilino]ethyl ester IUPAC Name: 2-[3-methyl-N-(2-methylsulfonyloxyethyl)-4-phenyldiazenylanilino]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[3-methyl-N-(2-methylsulfonyloxyethyl)-4-phenylazo-anilino]ethyl ester Formula: C19H25N3O6S2 MolecularWeight: 455.5483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O6S2/c1-16-15-18(9-10-19(16)21-20-17-7-5-4-6-8-17)22(11-13-27-29(2,23)24)12-14-28-30(3,25)26/h4-10,15H,11-14H2,1-3H3