methyl 4-chloranyl-2-[2-chloroethyl-(4-methylphenyl)sulfonyl-amino]benzoate

Systemtic Name: methyl 4-chloranyl-2-[2-chloroethyl-(4-methylphenyl)sulfonyl-amino]benzoate Openeye Name: methyl 4-chloro-2-[2-chloroethyl(p-tolylsulfonyl)amino]benzoate CAS Name: 4-chloro-2-[2-chloroethyl-(4-methylphenyl)sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[2-chloroethyl-(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-chloro-2-[2-chloroethyl(tosyl)amino]benzoic acid methyl ester Formula: C17H17Cl2NO4S MolecularWeight: 402.29218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCl)C2=C(C=CC(=C2)Cl)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCl)C2=C(C=CC(=C2)Cl)C(=O)OC

InChI

InChI=1S/C17H17Cl2NO4S/c1-12-3-6-14(7-4-12)25(22,23)20(10-9-18)16-11-13(19)5-8-15(16)17(21)24-2/h3-8,11H,9-10H2,1-2H3