methyl 3-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-sulfamoyl]benzoate

Systemtic Name: methyl 3-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-sulfamoyl]benzoate Openeye Name: methyl 3-[(2-chloro-5-nitro-phenyl)methyl-methyl-sulfamoyl]benzoate CAS Name: 3-[(2-chloro-5-nitrophenyl)methyl-methylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(2-chloro-5-nitrophenyl)methyl-methylsulfamoyl]benzoate Traditional Name: 3-[(2-chloro-5-nitro-benzyl)-methyl-sulfamoyl]benzoic acid methyl ester Formula: C16H15ClN2O6S MolecularWeight: 398.8181

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C16H15ClN2O6S/c1-18(10-12-8-13(19(21)22)6-7-15(12)17)26(23,24)14-5-3-4-11(9-14)16(20)25-2/h3-9H,10H2,1-2H3