4-ethoxy-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-nitro-benzamide

Systemtic Name: 4-ethoxy-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-nitro-benzamide Openeye Name: 4-ethoxy-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-nitro-benzamide CAS Name: 4-ethoxy-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-nitrobenzamide IUPAC Name: 4-ethoxy-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-3-nitrobenzamide Traditional Name: 4-ethoxy-N-[4-(methylsulfamoylmethyl)benzyl]-3-nitro-benzamide Formula: C18H21N3O6S MolecularWeight: 407.44084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)CS(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)CS(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O6S/c1-3-27-17-9-8-15(10-16(17)21(23)24)18(22)20-11-13-4-6-14(7-5-13)12-28(25,26)19-2/h4-10,19H,3,11-12H2,1-2H3,(H,20,22)