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

Systemtic Name: 2-[methylsulfonyl(phenyl)amino]-N-(3-nitrophenyl)propanamide Openeye Name: 2-(N-methylsulfonylanilino)-N-(3-nitrophenyl)propanamide CAS Name: 2-(N-methylsulfonylanilino)-N-(3-nitrophenyl)propanamide IUPAC Name: 2-(N-methylsulfonylanilino)-N-(3-nitrophenyl)propanamide Traditional Name: 2-(N-mesylanilino)-N-(3-nitrophenyl)propionamide Formula: C16H17N3O5S MolecularWeight: 363.38828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O5S/c1-12(18(25(2,23)24)14-8-4-3-5-9-14)16(20)17-13-7-6-10-15(11-13)19(21)22/h3-12H,1-2H3,(H,17,20)