2-[4-[3-ethylsulfonyl-5-(4-fluorophenyl)-4-methoxy-phenyl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[3-ethylsulfonyl-5-(4-fluorophenyl)-4-methoxy-phenyl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[3-ethylsulfonyl-5-(4-fluorophenyl)-4-methoxy-phenyl]piperazin-1-yl]ethanol CAS Name: 2-[4-[3-ethylsulfonyl-5-(4-fluorophenyl)-4-methoxyphenyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[3-ethylsulfonyl-5-(4-fluorophenyl)-4-methoxyphenyl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[3-esyl-5-(4-fluorophenyl)-4-methoxy-phenyl]piperazino]ethanol Formula: C21H27FN2O4S MolecularWeight: 422.513483

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C(=CC(=C1)N2CCN(CC2)CCO)C3=CC=C(C=C3)F)OC

Isomeric SMILES

CCS(=O)(=O)C1=C(C(=CC(=C1)N2CCN(CC2)CCO)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H27FN2O4S/c1-3-29(26,27)20-15-18(24-10-8-23(9-11-24)12-13-25)14-19(21(20)28-2)16-4-6-17(22)7-5-16/h4-7,14-15,25H,3,8-13H2,1-2H3