(4-nitrophenyl) N-[2-chloroethyl(methylsulfonyl)amino]-N-methylsulfonyl-carbamate

Systemtic Name: (4-nitrophenyl) N-[2-chloroethyl(methylsulfonyl)amino]-N-methylsulfonyl-carbamate Openeye Name: (4-nitrophenyl) N-[2-chloroethyl(methylsulfonyl)amino]-N-methylsulfonyl-carbamate CAS Name: N-[2-chloroethyl(methylsulfonyl)amino]-N-methylsulfonylcarbamic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) N-[2-chloroethyl(methylsulfonyl)amino]-N-methylsulfonylcarbamate Traditional Name: N-[2-chloroethyl(mesyl)amino]-N-mesyl-carbamic acid (4-nitrophenyl) ester Formula: C11H14ClN3O8S2 MolecularWeight: 415.82716

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCl)N(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)N(CCCl)N(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C11H14ClN3O8S2/c1-24(19,20)13(8-7-12)14(25(2,21)22)11(16)23-10-5-3-9(4-6-10)15(17)18/h3-6H,7-8H2,1-2H3