dimethyl 2-[4-[(2-methylphenyl)sulfamoyl]-2-nitro-phenyl]propanedioate

Systemtic Name: dimethyl 2-[4-[(2-methylphenyl)sulfamoyl]-2-nitro-phenyl]propanedioate Openeye Name: dimethyl 2-[2-nitro-4-(o-tolylsulfamoyl)phenyl]propanedioate CAS Name: 2-[4-[(2-methylphenyl)sulfamoyl]-2-nitrophenyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[4-[(2-methylphenyl)sulfamoyl]-2-nitrophenyl]propanedioate Traditional Name: 2-[2-nitro-4-(o-tolylsulfamoyl)phenyl]malonic acid dimethyl ester Formula: C18H18N2O8S MolecularWeight: 422.40912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)C(C(=O)OC)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)C(C(=O)OC)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O8S/c1-11-6-4-5-7-14(11)19-29(25,26)12-8-9-13(15(10-12)20(23)24)16(17(21)27-2)18(22)28-3/h4-10,16,19H,1-3H3