5-[bis(2-chloroethyl)amino]-N-methylsulfonyl-2,4-dinitro-benzenesulfonamide

Systemtic Name: 5-[bis(2-chloroethyl)amino]-N-methylsulfonyl-2,4-dinitro-benzenesulfonamide Openeye Name: 5-[bis(2-chloroethyl)amino]-N-methylsulfonyl-2,4-dinitro-benzenesulfonamide CAS Name: 5-[bis(2-chloroethyl)amino]-N-methylsulfonyl-2,4-dinitrobenzenesulfonamide IUPAC Name: 5-[bis(2-chloroethyl)amino]-N-methylsulfonyl-2,4-dinitrobenzenesulfonamide Traditional Name: 5-[bis(2-chloroethyl)amino]-N-mesyl-2,4-dinitro-benzenesulfonamide Formula: C11H14Cl2N4O8S2 MolecularWeight: 465.28686

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NS(=O)(=O)C1=C(C=C(C(=C1)N(CCCl)CCCl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)NS(=O)(=O)C1=C(C=C(C(=C1)N(CCCl)CCCl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H14Cl2N4O8S2/c1-26(22,23)14-27(24,25)11-7-8(15(4-2-12)5-3-13)9(16(18)19)6-10(11)17(20)21/h6-7,14H,2-5H2,1H3