(2-methoxyphenyl) 3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzoate

Systemtic Name: (2-methoxyphenyl) 3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzoate Openeye Name: (2-methoxyphenyl) 3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]benzoic acid (2-methoxyphenyl) ester IUPAC Name: (2-methoxyphenyl) 3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 3-[4-(4-fluorophenyl)piperazino]sulfonylbenzoic acid (2-methoxyphenyl) ester Formula: C24H23FN2O5S MolecularWeight: 470.513223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC=C1OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H23FN2O5S/c1-31-22-7-2-3-8-23(22)32-24(28)18-5-4-6-21(17-18)33(29,30)27-15-13-26(14-16-27)20-11-9-19(25)10-12-20/h2-12,17H,13-16H2,1H3