2-[(4-methylphenyl)-[2-(4-methylphenyl)sulfonyloxyethyl]amino]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[(4-methylphenyl)-[2-(4-methylphenyl)sulfonyloxyethyl]amino]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[4-methyl-N-[2-(p-tolylsulfonyloxy)ethyl]anilino]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[4-methyl-N-[2-(4-methylphenyl)sulfonyloxyethyl]anilino]ethyl ester IUPAC Name: 2-[4-methyl-N-[2-(4-methylphenyl)sulfonyloxyethyl]anilino]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[4-methyl-N-(2-tosyloxyethyl)anilino]ethyl ester Formula: C25H29NO6S2 MolecularWeight: 503.63086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCOS(=O)(=O)C2=CC=C(C=C2)C)CCOS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCOS(=O)(=O)C2=CC=C(C=C2)C)CCOS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H29NO6S2/c1-20-4-10-23(11-5-20)26(16-18-31-33(27,28)24-12-6-21(2)7-13-24)17-19-32-34(29,30)25-14-8-22(3)9-15-25/h4-15H,16-19H2,1-3H3