2-[(4-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[(4-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[4-methoxy-N-(p-tolylsulfonyl)anilino]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(4-methoxy-N-(4-methylphenyl)sulfonylanilino)ethyl ester IUPAC Name: 2-(4-methoxy-N-(4-methylphenyl)sulfonylanilino)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(4-methoxy-N-tosyl-anilino)ethyl ester Formula: C23H25NO6S2 MolecularWeight: 475.5777

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25NO6S2/c1-18-4-12-22(13-5-18)31(25,26)24(20-8-10-21(29-3)11-9-20)16-17-30-32(27,28)23-14-6-19(2)7-15-23/h4-15H,16-17H2,1-3H3