methyl 4-[[4-(diethylsulfamoyl)-2-nitro-phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[4-(diethylsulfamoyl)-2-nitro-phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-(diethylsulfamoyl)-2-nitro-phenoxy]methyl]benzoate CAS Name: 4-[[4-(diethylsulfamoyl)-2-nitrophenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(diethylsulfamoyl)-2-nitrophenoxy]methyl]benzoate Traditional Name: 4-[[4-(diethylsulfamoyl)-2-nitro-phenoxy]methyl]benzoic acid methyl ester Formula: C19H22N2O7S MolecularWeight: 422.45218

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O7S/c1-4-20(5-2)29(25,26)16-10-11-18(17(12-16)21(23)24)28-13-14-6-8-15(9-7-14)19(22)27-3/h6-12H,4-5,13H2,1-3H3