1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanone

Systemtic Name: 1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanone Openeye Name: 2-(4-allyl-2-methoxy-phenoxy)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]-2-(2-methoxy-4-prop-2-enylphenoxy)ethanone IUPAC Name: 1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-2-(2-methoxy-4-prop-2-enylphenoxy)ethanone Traditional Name: 2-(4-allyl-2-methoxy-phenoxy)-1-[4-(2-fluorophenyl)sulfonylpiperazino]ethanone Formula: C22H25FN2O5S MolecularWeight: 448.507703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H25FN2O5S/c1-3-6-17-9-10-19(20(15-17)29-2)30-16-22(26)24-11-13-25(14-12-24)31(27,28)21-8-5-4-7-18(21)23/h3-5,7-10,15H,1,6,11-14,16H2,2H3