2-[methylsulfonyl(phenyl)amino]-N-(3-nitrophenyl)butanamide

Systemtic Name: 2-[methylsulfonyl(phenyl)amino]-N-(3-nitrophenyl)butanamide Openeye Name: 2-(N-methylsulfonylanilino)-N-(3-nitrophenyl)butanamide CAS Name: 2-(N-methylsulfonylanilino)-N-(3-nitrophenyl)butanamide IUPAC Name: 2-(N-methylsulfonylanilino)-N-(3-nitrophenyl)butanamide Traditional Name: 2-(N-mesylanilino)-N-(3-nitrophenyl)butyramide Formula: C17H19N3O5S MolecularWeight: 377.41486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C17H19N3O5S/c1-3-16(19(26(2,24)25)14-9-5-4-6-10-14)17(21)18-13-8-7-11-15(12-13)20(22)23/h4-12,16H,3H2,1-2H3,(H,18,21)