1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-(2-methoxy-5-prop-2-enyl-phenoxy)ethanone

Systemtic Name: 1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]-2-(2-methoxy-5-prop-2-enyl-phenoxy)ethanone Openeye Name: 2-(5-allyl-2-methoxy-phenoxy)-1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-piperazin-1-yl]ethanone CAS Name: 1-[4-[(4-fluorophenyl)methyl]-2,5-dimethyl-1-piperazinyl]-2-(2-methoxy-5-prop-2-enylphenoxy)ethanone IUPAC Name: 1-[4-[(4-fluorophenyl)methyl]-2,5-dimethylpiperazin-1-yl]-2-(2-methoxy-5-prop-2-enylphenoxy)ethanone Traditional Name: 2-(5-allyl-2-methoxy-phenoxy)-1-[4-(4-fluorobenzyl)-2,5-dimethyl-piperazino]ethanone Formula: C25H31FN2O3 MolecularWeight: 426.523643

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)COC2=C(C=CC(=C2)CC=C)OC)C)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1CN(C(CN1C(=O)COC2=C(C=CC(=C2)CC=C)OC)C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C25H31FN2O3/c1-5-6-20-9-12-23(30-4)24(13-20)31-17-25(29)28-15-18(2)27(14-19(28)3)16-21-7-10-22(26)11-8-21/h5,7-13,18-19H,1,6,14-17H2,2-4H3