2-[methylsulfonyl-(4-phenoxyphenyl)amino]-N-(3-nitrophenyl)propanamide

Systemtic Name: 2-[methylsulfonyl-(4-phenoxyphenyl)amino]-N-(3-nitrophenyl)propanamide Openeye Name: 2-(N-methylsulfonyl-4-phenoxy-anilino)-N-(3-nitrophenyl)propanamide CAS Name: 2-(N-methylsulfonyl-4-phenoxyanilino)-N-(3-nitrophenyl)propanamide IUPAC Name: 2-(N-methylsulfonyl-4-phenoxyanilino)-N-(3-nitrophenyl)propanamide Traditional Name: 2-(N-mesyl-4-phenoxy-anilino)-N-(3-nitrophenyl)propionamide Formula: C22H21N3O6S MolecularWeight: 455.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])N(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])N(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C22H21N3O6S/c1-16(22(26)23-17-7-6-8-19(15-17)25(27)28)24(32(2,29)30)18-11-13-21(14-12-18)31-20-9-4-3-5-10-20/h3-16H,1-2H3,(H,23,26)