N-(2,2-dimethoxyethyl)-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-(2,2-dimethoxyethyl)-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-(2,2-dimethoxyethyl)-4-methylsulfonyl-2-nitro-aniline CAS Name: N-(2,2-dimethoxyethyl)-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-(2,2-dimethoxyethyl)-4-methylsulfonyl-2-nitroaniline Traditional Name: 2,2-dimethoxyethyl-(4-mesyl-2-nitro-phenyl)amine Formula: C11H16N2O6S MolecularWeight: 304.31954

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-])OC

Isomeric SMILES

COC(CNC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-])OC

InChI

InChI=1S/C11H16N2O6S/c1-18-11(19-2)7-12-9-5-4-8(20(3,16)17)6-10(9)13(14)15/h4-6,11-12H,7H2,1-3H3