N-tert-butyl-4-(5-methanoyl-2-methoxy-phenoxy)-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-(5-methanoyl-2-methoxy-phenoxy)-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-(5-formyl-2-methoxy-phenoxy)-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-(5-formyl-2-methoxyphenoxy)-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-(5-formyl-2-methoxyphenoxy)-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-(5-formyl-2-methoxy-phenoxy)-3-nitro-benzenesulfonamide Formula: C18H20N2O7S MolecularWeight: 408.4256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=CC(=C2)C=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=CC(=C2)C=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O7S/c1-18(2,3)19-28(24,25)13-6-8-15(14(10-13)20(22)23)27-17-9-12(11-21)5-7-16(17)26-4/h5-11,19H,1-4H3