2-[(3-chlorophenyl)-[2-(4-methylphenyl)sulfonyloxyethyl]amino]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[(3-chlorophenyl)-[2-(4-methylphenyl)sulfonyloxyethyl]amino]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[3-chloro-N-[2-(p-tolylsulfonyloxy)ethyl]anilino]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[3-chloro-N-[2-(4-methylphenyl)sulfonyloxyethyl]anilino]ethyl ester IUPAC Name: 2-[3-chloro-N-[2-(4-methylphenyl)sulfonyloxyethyl]anilino]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[3-chloro-N-(2-tosyloxyethyl)anilino]ethyl ester Formula: C24H26ClNO6S2 MolecularWeight: 524.04934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCN(CCOS(=O)(=O)C2=CC=C(C=C2)C)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCN(CCOS(=O)(=O)C2=CC=C(C=C2)C)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C24H26ClNO6S2/c1-19-6-10-23(11-7-19)33(27,28)31-16-14-26(22-5-3-4-21(25)18-22)15-17-32-34(29,30)24-12-8-20(2)9-13-24/h3-13,18H,14-17H2,1-2H3