N-[(3,4-dimethoxyphenyl)methyl]-4-phenoxy-benzenesulfonamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-phenoxy-benzenesulfonamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-phenoxy-benzenesulfonamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-phenoxybenzenesulfonamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-phenoxybenzenesulfonamide Traditional Name: 4-phenoxy-N-veratryl-benzenesulfonamide Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)OC

InChI

InChI=1S/C21H21NO5S/c1-25-20-13-8-16(14-21(20)26-2)15-22-28(23,24)19-11-9-18(10-12-19)27-17-6-4-3-5-7-17/h3-14,22H,15H2,1-2H3