1-(4-fluorophenyl)-4-(3-methyl-4-pentoxy-phenyl)sulfonyl-piperazine

Systemtic Name: 1-(4-fluorophenyl)-4-(3-methyl-4-pentoxy-phenyl)sulfonyl-piperazine Openeye Name: 1-(4-fluorophenyl)-4-(3-methyl-4-pentoxy-phenyl)sulfonyl-piperazine CAS Name: 1-(4-fluorophenyl)-4-(3-methyl-4-pentoxyphenyl)sulfonylpiperazine IUPAC Name: 1-(4-fluorophenyl)-4-(3-methyl-4-pentoxyphenyl)sulfonylpiperazine Traditional Name: 1-(4-amoxy-3-methyl-phenyl)sulfonyl-4-(4-fluorophenyl)piperazine Formula: C22H29FN2O3S MolecularWeight: 420.540663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C22H29FN2O3S/c1-3-4-5-16-28-22-11-10-21(17-18(22)2)29(26,27)25-14-12-24(13-15-25)20-8-6-19(23)7-9-20/h6-11,17H,3-5,12-16H2,1-2H3