N-(3-chloranyl-4-methyl-phenyl)-4-[(3-nitrophenyl)methylsulfonylamino]benzenesulfonamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-4-[(3-nitrophenyl)methylsulfonylamino]benzenesulfonamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-4-[(3-nitrophenyl)methylsulfonylamino]benzenesulfonamide CAS Name: N-(3-chloro-4-methylphenyl)-4-[(3-nitrophenyl)methylsulfonylamino]benzenesulfonamide IUPAC Name: N-(3-chloro-4-methylphenyl)-4-[(3-nitrophenyl)methylsulfonylamino]benzenesulfonamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-4-[(3-nitrobenzyl)sulfonylamino]benzenesulfonamide Formula: C20H18ClN3O6S2 MolecularWeight: 495.95642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

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