1-(4,5-dimethoxy-2-methyl-phenyl)sulfonyl-4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazine

Systemtic Name: 1-(4,5-dimethoxy-2-methyl-phenyl)sulfonyl-4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazine Openeye Name: 1-(4,5-dimethoxy-2-methyl-phenyl)sulfonyl-4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazine CAS Name: 1-(4,5-dimethoxy-2-methylphenyl)sulfonyl-4-[(3-fluoro-4-methoxyphenyl)methyl]piperazine IUPAC Name: 1-(4,5-dimethoxy-2-methylphenyl)sulfonyl-4-[(3-fluoro-4-methoxyphenyl)methyl]piperazine Traditional Name: 1-(4,5-dimethoxy-2-methyl-phenyl)sulfonyl-4-(3-fluoro-4-methoxy-benzyl)piperazine Formula: C21H27FN2O5S MolecularWeight: 438.512883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F)OC)OC

InChI

InChI=1S/C21H27FN2O5S/c1-15-11-19(28-3)20(29-4)13-21(15)30(25,26)24-9-7-23(8-10-24)14-16-5-6-18(27-2)17(22)12-16/h5-6,11-13H,7-10,14H2,1-4H3