1-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone

Systemtic Name: 1-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone Openeye Name: 1-[4-(4-fluorobenzoyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone CAS Name: 1-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-2-(3,4,5-trimethoxyphenyl)ethanone IUPAC Name: 1-[4-(4-fluorobenzoyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone Traditional Name: 1-[4-(4-fluorobenzoyl)piperazino]-2-(3,4,5-trimethoxyphenyl)ethanone Formula: C22H25FN2O5 MolecularWeight: 416.442703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN2O5/c1-28-18-12-15(13-19(29-2)21(18)30-3)14-20(26)24-8-10-25(11-9-24)22(27)16-4-6-17(23)7-5-16/h4-7,12-13H,8-11,14H2,1-3H3