bis(2-chloroethyl) 2-[(4-methylphenyl)sulfonylamino]pentanedioate

Systemtic Name: bis(2-chloroethyl) 2-[(4-methylphenyl)sulfonylamino]pentanedioate Openeye Name: bis(2-chloroethyl) 2-(p-tolylsulfonylamino)pentanedioate CAS Name: 2-[(4-methylphenyl)sulfonylamino]pentanedioic acid bis(2-chloroethyl) ester IUPAC Name: bis(2-chloroethyl) 2-[(4-methylphenyl)sulfonylamino]pentanedioate Traditional Name: 2-(tosylamino)glutaric acid bis(2-chloroethyl) ester Formula: C16H21Cl2NO6S MolecularWeight: 426.31204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCC(=O)OCCCl)C(=O)OCCCl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCC(=O)OCCCl)C(=O)OCCCl

InChI

InChI=1S/C16H21Cl2NO6S/c1-12-2-4-13(5-3-12)26(22,23)19-14(16(21)25-11-9-18)6-7-15(20)24-10-8-17/h2-5,14,19H,6-11H2,1H3