[3-(dimethylsulfamoyl)phenyl]methyl 4-ethoxy-3-nitro-benzoate

Systemtic Name: [3-(dimethylsulfamoyl)phenyl]methyl 4-ethoxy-3-nitro-benzoate Openeye Name: [3-(dimethylsulfamoyl)phenyl]methyl 4-ethoxy-3-nitro-benzoate CAS Name: 4-ethoxy-3-nitrobenzoic acid [3-(dimethylsulfamoyl)phenyl]methyl ester IUPAC Name: [3-(dimethylsulfamoyl)phenyl]methyl 4-ethoxy-3-nitrobenzoate Traditional Name: 4-ethoxy-3-nitro-benzoic acid [3-(dimethylsulfamoyl)benzyl] ester Formula: C18H20N2O7S MolecularWeight: 408.4256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O7S/c1-4-26-17-9-8-14(11-16(17)20(22)23)18(21)27-12-13-6-5-7-15(10-13)28(24,25)19(2)3/h5-11H,4,12H2,1-3H3