4-chloranyl-N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-3-nitro-benzamide

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN3O5S/c1-24(14-15-5-3-2-4-6-15)31(29,30)18-10-8-17(9-11-18)23-21(26)16-7-12-19(22)20(13-16)25(27)28/h2-13H,14H2,1H3,(H,23,26)