N-tert-butyl-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide

Systemtic Name: N-tert-butyl-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide Openeye Name: N-tert-butyl-2-(N-methylsulfonyl-3-nitro-anilino)acetamide CAS Name: N-tert-butyl-2-(N-methylsulfonyl-3-nitroanilino)acetamide IUPAC Name: N-tert-butyl-2-(N-methylsulfonyl-3-nitroanilino)acetamide Traditional Name: N-tert-butyl-2-(N-mesyl-3-nitro-anilino)acetamide Formula: C13H19N3O5S MolecularWeight: 329.37206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O5S/c1-13(2,3)14-12(17)9-15(22(4,20)21)10-6-5-7-11(8-10)16(18)19/h5-8H,9H2,1-4H3,(H,14,17)