N-(4-ethoxyphenyl)-4-[(3-nitrophenyl)methylsulfonylamino]benzenesulfonamide

Systemtic Name: N-(4-ethoxyphenyl)-4-[(3-nitrophenyl)methylsulfonylamino]benzenesulfonamide Openeye Name: N-(4-ethoxyphenyl)-4-[(3-nitrophenyl)methylsulfonylamino]benzenesulfonamide CAS Name: N-(4-ethoxyphenyl)-4-[(3-nitrophenyl)methylsulfonylamino]benzenesulfonamide IUPAC Name: N-(4-ethoxyphenyl)-4-[(3-nitrophenyl)methylsulfonylamino]benzenesulfonamide Traditional Name: 4-[(3-nitrobenzyl)sulfonylamino]-N-p-phenetyl-benzenesulfonamide Formula: C21H21N3O7S2 MolecularWeight: 491.53734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O7S2/c1-2-31-20-10-6-18(7-11-20)23-33(29,30)21-12-8-17(9-13-21)22-32(27,28)15-16-4-3-5-19(14-16)24(25)26/h3-14,22-23H,2,15H2,1H3