4-(3,5-dimethoxyphenoxy)-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-(3,5-dimethoxyphenoxy)-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-(3,5-dimethoxyphenoxy)-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide CAS Name: 4-(3,5-dimethoxyphenoxy)-N-(4-methoxyphenyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-(3,5-dimethoxyphenoxy)-N-(4-methoxyphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-(3,5-dimethoxyphenoxy)-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide Formula: C21H20N2O8S MolecularWeight: 460.4571

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC3=CC(=CC(=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC3=CC(=CC(=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O8S/c1-28-15-6-4-14(5-7-15)22-32(26,27)19-8-9-21(20(13-19)23(24)25)31-18-11-16(29-2)10-17(12-18)30-3/h4-13,22H,1-3H3