N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-methoxy-5-nitrophenyl)sulfamoyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-methoxy-5-nitrophenyl)sulfamoyl]benzamide Traditional Name: 4-[(2-methoxy-5-nitro-phenyl)sulfamoyl]-N-piperonyl-benzamide Formula: C22H19N3O8S MolecularWeight: 485.46656

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)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H19N3O8S/c1-31-19-9-5-16(25(27)28)11-18(19)24-34(29,30)17-6-3-15(4-7-17)22(26)23-12-14-2-8-20-21(10-14)33-13-32-20/h2-11,24H,12-13H2,1H3,(H,23,26)