(3-nitrophenyl)methyl 4-chloranyl-3-(diethylsulfamoyl)benzoate

Systemtic Name: (3-nitrophenyl)methyl 4-chloranyl-3-(diethylsulfamoyl)benzoate Openeye Name: (3-nitrophenyl)methyl 4-chloro-3-(diethylsulfamoyl)benzoate CAS Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 4-chloro-3-(diethylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid (3-nitrobenzyl) ester Formula: C18H19ClN2O6S MolecularWeight: 426.87126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN2O6S/c1-3-20(4-2)28(25,26)17-11-14(8-9-16(17)19)18(22)27-12-13-6-5-7-15(10-13)21(23)24/h5-11H,3-4,12H2,1-2H3