N-[4-[butyl(methyl)sulfamoyl]phenyl]-3-nitro-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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