4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]-N-phenethyl-benzamide

Systemtic Name: 4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]-N-phenethyl-benzamide Openeye Name: 4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]-N-phenethyl-benzamide CAS Name: 4-[(2-methoxy-5-nitrophenyl)sulfamoyl]-N-phenethylbenzamide IUPAC Name: 4-[(2-methoxy-5-nitrophenyl)sulfamoyl]-N-phenethylbenzamide Traditional Name: 4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]-N-phenethyl-benzamide Formula: C22H21N3O6S MolecularWeight: 455.48364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O6S/c1-31-21-12-9-18(25(27)28)15-20(21)24-32(29,30)19-10-7-17(8-11-19)22(26)23-14-13-16-5-3-2-4-6-16/h2-12,15,24H,13-14H2,1H3,(H,23,26)