1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-(2-fluoranyl-4,5-dimethoxy-phenyl)sulfonyl-piperazine

Systemtic Name: 1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-(2-fluoranyl-4,5-dimethoxy-phenyl)sulfonyl-piperazine Openeye Name: 1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-4-(2-fluoro-4,5-dimethoxy-phenyl)sulfonyl-piperazine CAS Name: 1-[(4,5-dimethoxy-2-methylphenyl)methyl]-4-(2-fluoro-4,5-dimethoxyphenyl)sulfonylpiperazine IUPAC Name: 1-[(4,5-dimethoxy-2-methylphenyl)methyl]-4-(2-fluoro-4,5-dimethoxyphenyl)sulfonylpiperazine Traditional Name: 1-(4,5-dimethoxy-2-methyl-benzyl)-4-(2-fluoro-4,5-dimethoxy-phenyl)sulfonyl-piperazine Formula: C22H29FN2O6S MolecularWeight: 468.538863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)OC)OC)F)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)OC)OC)F)OC)OC

InChI

InChI=1S/C22H29FN2O6S/c1-15-10-18(28-2)19(29-3)11-16(15)14-24-6-8-25(9-7-24)32(26,27)22-13-21(31-5)20(30-4)12-17(22)23/h10-13H,6-9,14H2,1-5H3