1-(2,5-dimethylphenyl)-4-[3-(4-fluoranylphenoxy)propylsulfonyl]piperazine

Systemtic Name: 1-(2,5-dimethylphenyl)-4-[3-(4-fluoranylphenoxy)propylsulfonyl]piperazine Openeye Name: 1-(2,5-dimethylphenyl)-4-[3-(4-fluorophenoxy)propylsulfonyl]piperazine CAS Name: 1-(2,5-dimethylphenyl)-4-[3-(4-fluorophenoxy)propylsulfonyl]piperazine IUPAC Name: 1-(2,5-dimethylphenyl)-4-[3-(4-fluorophenoxy)propylsulfonyl]piperazine Traditional Name: 1-(2,5-dimethylphenyl)-4-[3-(4-fluorophenoxy)propylsulfonyl]piperazine Formula: C21H27FN2O3S MolecularWeight: 406.514083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)CCCOC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)CCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C21H27FN2O3S/c1-17-4-5-18(2)21(16-17)23-10-12-24(13-11-23)28(25,26)15-3-14-27-20-8-6-19(22)7-9-20/h4-9,16H,3,10-15H2,1-2H3