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

Systemtic Name: (4-nitrophenyl)methyl N-[2-chloroethyl(methylsulfonyl)amino]-N-methylsulfonyl-carbamate Openeye Name: (4-nitrophenyl)methyl N-[2-chloroethyl(methylsulfonyl)amino]-N-methylsulfonyl-carbamate CAS Name: N-[2-chloroethyl(methylsulfonyl)amino]-N-methylsulfonylcarbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[2-chloroethyl(methylsulfonyl)amino]-N-methylsulfonylcarbamate Traditional Name: N-[2-chloroethyl(mesyl)amino]-N-mesyl-carbamic acid (4-nitrobenzyl) ester Formula: C12H16ClN3O8S2 MolecularWeight: 429.85374

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCl)N(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)N(CCCl)N(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C12H16ClN3O8S2/c1-25(20,21)14(8-7-13)15(26(2,22)23)12(17)24-9-10-3-5-11(6-4-10)16(18)19/h3-6H,7-9H2,1-2H3