methyl N-(4-methylsulfonyl-2,6-dinitro-phenyl)carbamate

Systemtic Name: methyl N-(4-methylsulfonyl-2,6-dinitro-phenyl)carbamate Openeye Name: methyl N-(4-methylsulfonyl-2,6-dinitro-phenyl)carbamate CAS Name: N-(4-methylsulfonyl-2,6-dinitrophenyl)carbamic acid methyl ester IUPAC Name: methyl N-(4-methylsulfonyl-2,6-dinitrophenyl)carbamate Traditional Name: N-(4-mesyl-2,6-dinitro-phenyl)carbamic acid methyl ester Formula: C9H9N3O8S MolecularWeight: 319.24806

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COC(=O)NC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C9H9N3O8S/c1-20-9(13)10-8-6(11(14)15)3-5(21(2,18)19)4-7(8)12(16)17/h3-4H,1-2H3,(H,10,13)