3-(5-methyl-2-nitro-phenoxy)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(5-methyl-2-nitro-phenoxy)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(5-methyl-2-nitro-phenoxy)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]propanamide CAS Name: 3-(5-methyl-2-nitrophenoxy)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(5-methyl-2-nitrophenoxy)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(5-methyl-2-nitro-phenoxy)-N-[4-(methylsulfamoylmethyl)benzyl]propionamide Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OCCC(=O)NCC2=CC=C(C=C2)CS(=O)(=O)NC

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OCCC(=O)NCC2=CC=C(C=C2)CS(=O)(=O)NC

InChI

InChI=1S/C19H23N3O6S/c1-14-3-8-17(22(24)25)18(11-14)28-10-9-19(23)21-12-15-4-6-16(7-5-15)13-29(26,27)20-2/h3-8,11,20H,9-10,12-13H2,1-2H3,(H,21,23)