4-chloranyl-N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-3-nitro-benzamide Formula: C21H18ClN3O5S MolecularWeight: 459.90272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C21H18ClN3O5S/c1-13-9-14(2)11-17(10-13)24-31(29,30)18-6-4-16(5-7-18)23-21(26)15-3-8-19(22)20(12-15)25(27)28/h3-12,24H,1-2H3,(H,23,26)