N-[4-(butylsulfamoyl)phenyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[4-(butylsulfamoyl)phenyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[4-(butylsulfamoyl)phenyl]-2-methyl-3-nitro-benzamide CAS Name: N-[4-(butylsulfamoyl)phenyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[4-(butylsulfamoyl)phenyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[4-(butylsulfamoyl)phenyl]-2-methyl-3-nitro-benzamide Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C18H21N3O5S/c1-3-4-12-19-27(25,26)15-10-8-14(9-11-15)20-18(22)16-6-5-7-17(13(16)2)21(23)24/h5-11,19H,3-4,12H2,1-2H3,(H,20,22)