4-tert-butyl-N-[4-[ethanoyl(methyl)amino]phenyl]-N-methylsulfonyl-3-nitro-benzamide

Systemtic Name: 4-tert-butyl-N-[4-[ethanoyl(methyl)amino]phenyl]-N-methylsulfonyl-3-nitro-benzamide Openeye Name: N-[4-[acetyl(methyl)amino]phenyl]-4-tert-butyl-N-methylsulfonyl-3-nitro-benzamide CAS Name: N-[4-[acetyl(methyl)amino]phenyl]-4-tert-butyl-N-methylsulfonyl-3-nitrobenzamide IUPAC Name: N-[4-[acetyl(methyl)amino]phenyl]-4-tert-butyl-N-methylsulfonyl-3-nitrobenzamide Traditional Name: N-[4-[acetyl(methyl)amino]phenyl]-4-tert-butyl-N-mesyl-3-nitro-benzamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O6S/c1-14(25)22(5)16-8-10-17(11-9-16)23(31(6,29)30)20(26)15-7-12-18(21(2,3)4)19(13-15)24(27)28/h7-13H,1-6H3