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

Systemtic Name: 5-[bis(2-chloroethyl)amino]-2,4-dinitro-benzenesulfonamide Openeye Name: 5-[bis(2-chloroethyl)amino]-2,4-dinitro-benzenesulfonamide CAS Name: 5-[bis(2-chloroethyl)amino]-2,4-dinitrobenzenesulfonamide IUPAC Name: 5-[bis(2-chloroethyl)amino]-2,4-dinitrobenzenesulfonamide Traditional Name: 5-[bis(2-chloroethyl)amino]-2,4-dinitro-benzenesulfonamide Formula: C10H12Cl2N4O6S MolecularWeight: 387.19648

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1S(=O)(=O)N)[N+](=O)[O-])[N+](=O)[O-])N(CCCl)CCCl

Isomeric SMILES

C1=C(C(=CC(=C1S(=O)(=O)N)[N+](=O)[O-])[N+](=O)[O-])N(CCCl)CCCl

InChI

InChI=1S/C10H12Cl2N4O6S/c11-1-3-14(4-2-12)7-6-10(23(13,21)22)9(16(19)20)5-8(7)15(17)18/h5-6H,1-4H2,(H2,13,21,22)