4-[2-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]ethoxy]benzenesulfonamide

Systemtic Name: 4-[2-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]ethoxy]benzenesulfonamide Traditional Name: 4-[2-[4-(3-fluoro-4-methoxy-benzyl)piperazino]ethoxy]benzenesulfonamide Formula: C20H26FN3O4S MolecularWeight: 423.501543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)CCOC3=CC=C(C=C3)S(=O)(=O)N)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)CCOC3=CC=C(C=C3)S(=O)(=O)N)F

InChI

InChI=1S/C20H26FN3O4S/c1-27-20-7-2-16(14-19(20)21)15-24-10-8-23(9-11-24)12-13-28-17-3-5-18(6-4-17)29(22,25)26/h2-7,14H,8-13,15H2,1H3,(H2,22,25,26)