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

Systemtic Name: 4-chloranyl-N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-4-chloro-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-4-chloro-3-nitrobenzenesulfonamide Traditional Name: N-[4-[benzyl(methyl)sulfamoyl]phenyl]-4-chloro-3-nitro-benzenesulfonamide Formula: C20H18ClN3O6S2 MolecularWeight: 495.95642

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C20H18ClN3O6S2/c1-23(14-15-5-3-2-4-6-15)32(29,30)17-9-7-16(8-10-17)22-31(27,28)18-11-12-19(21)20(13-18)24(25)26/h2-13,22H,14H2,1H3