1-[(3,4-dimethoxyphenyl)methyl]-4-[(4-fluorophenyl)methylsulfonyl]piperazine

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(4-fluorophenyl)methylsulfonyl]piperazine Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(4-fluorophenyl)methylsulfonyl]piperazine CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(4-fluorophenyl)methylsulfonyl]piperazine IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(4-fluorophenyl)methylsulfonyl]piperazine Traditional Name: 1-(4-fluorobenzyl)sulfonyl-4-veratryl-piperazine Formula: C20H25FN2O4S MolecularWeight: 408.486903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C20H25FN2O4S/c1-26-19-8-5-17(13-20(19)27-2)14-22-9-11-23(12-10-22)28(24,25)15-16-3-6-18(21)7-4-16/h3-8,13H,9-12,14-15H2,1-2H3