1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-(4-hexoxyphenoxy)ethanone

Systemtic Name: 1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-(4-hexoxyphenoxy)ethanone Openeye Name: 1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-(4-hexoxyphenoxy)ethanone CAS Name: 1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-1-piperazinyl]-2-(4-hexoxyphenoxy)ethanone IUPAC Name: 1-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-2-(4-hexoxyphenoxy)ethanone Traditional Name: 1-[4-(4-fluorobenzyl)-2,5-dimethyl-piperazino]-2-(4-hexoxyphenoxy)ethanone Formula: C27H37FN2O3 MolecularWeight: 456.592683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OCC(=O)N2CC(N(CC2C)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OCC(=O)N2CC(N(CC2C)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C27H37FN2O3/c1-4-5-6-7-16-32-25-12-14-26(15-13-25)33-20-27(31)30-18-21(2)29(17-22(30)3)19-23-8-10-24(28)11-9-23/h8-15,21-22H,4-7,16-20H2,1-3H3