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

Systemtic Name: methyl 3-[[4-(ethanoylsulfamoyl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[4-(acetylsulfamoyl)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[4-(acetylsulfamoyl)anilino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[4-(acetylsulfamoyl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4-(acetylsulfamoyl)phenyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C17H15N3O8S MolecularWeight: 421.3813

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O8S/c1-10(21)19-29(26,27)15-5-3-13(4-6-15)18-16(22)11-7-12(17(23)28-2)9-14(8-11)20(24)25/h3-9H,1-2H3,(H,18,22)(H,19,21)