N-[(3,4-dimethoxyphenyl)methyl]-4-fluoranyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-fluoranyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-fluoro-N-(2-morpholinoethyl)benzenesulfonamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-fluoro-N-[2-(4-morpholinyl)ethyl]benzenesulfonamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-fluoro-N-(2-morpholin-4-ylethyl)benzenesulfonamide Traditional Name: 4-fluoro-N-(2-morpholinoethyl)-N-veratryl-benzenesulfonamide Formula: C21H27FN2O5S MolecularWeight: 438.512883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CCN2CCOCC2)S(=O)(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CCN2CCOCC2)S(=O)(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H27FN2O5S/c1-27-20-8-3-17(15-21(20)28-2)16-24(10-9-23-11-13-29-14-12-23)30(25,26)19-6-4-18(22)5-7-19/h3-8,15H,9-14,16H2,1-2H3