2-ethoxy-6-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-phenyl-methyl]phenol

Systemtic Name: 2-ethoxy-6-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-phenyl-methyl]phenol Openeye Name: 2-ethoxy-6-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-phenyl-methyl]phenol CAS Name: 2-ethoxy-6-[[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-phenylmethyl]phenol IUPAC Name: 2-ethoxy-6-[[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-phenylmethyl]phenol Traditional Name: 2-ethoxy-6-[[4-(4-fluorophenyl)sulfonylpiperazino]-phenyl-methyl]phenol Formula: C25H27FN2O4S MolecularWeight: 470.556283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C(C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=CC(=C1O)C(C2=CC=CC=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H27FN2O4S/c1-2-32-23-10-6-9-22(25(23)29)24(19-7-4-3-5-8-19)27-15-17-28(18-16-27)33(30,31)21-13-11-20(26)12-14-21/h3-14,24,29H,2,15-18H2,1H3