N-tert-butyl-3-nitro-4-[4-(3-oxidanylidenebutyl)phenoxy]benzenesulfonamide

Systemtic Name: N-tert-butyl-3-nitro-4-[4-(3-oxidanylidenebutyl)phenoxy]benzenesulfonamide Openeye Name: N-tert-butyl-3-nitro-4-[4-(3-oxobutyl)phenoxy]benzenesulfonamide CAS Name: N-tert-butyl-3-nitro-4-[4-(3-oxobutyl)phenoxy]benzenesulfonamide IUPAC Name: N-tert-butyl-3-nitro-4-[4-(3-oxobutyl)phenoxy]benzenesulfonamide Traditional Name: N-tert-butyl-4-[4-(3-ketobutyl)phenoxy]-3-nitro-benzenesulfonamide Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O6S/c1-14(23)5-6-15-7-9-16(10-8-15)28-19-12-11-17(13-18(19)22(24)25)29(26,27)21-20(2,3)4/h7-13,21H,5-6H2,1-4H3