methyl 3-[[3-(dimethylsulfamoyl)-4-methyl-phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[3-(dimethylsulfamoyl)-4-methyl-phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[3-(dimethylsulfamoyl)-4-methyl-phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[3-(dimethylsulfamoyl)-4-methylanilino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[3-(dimethylsulfamoyl)-4-methylphenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[3-(dimethylsulfamoyl)-4-methyl-phenyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C18H19N3O7S MolecularWeight: 421.42436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O7S/c1-11-5-6-14(10-16(11)29(26,27)20(2)3)19-17(22)12-7-13(18(23)28-4)9-15(8-12)21(24)25/h5-10H,1-4H3,(H,19,22)