4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)butan-1-one

Systemtic Name: 4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)butan-1-one Openeye Name: 4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)butan-1-one CAS Name: 4-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-1-(3,4,5-trimethoxyphenyl)-1-butanone IUPAC Name: 4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1-(3,4,5-trimethoxyphenyl)butan-1-one Traditional Name: 4-[4-[3-(trifluoromethyl)phenyl]piperazino]-1-(3,4,5-trimethoxyphenyl)butan-1-one Formula: C24H29F3N2O4 MolecularWeight: 466.49327

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)CCCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)CCCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C24H29F3N2O4/c1-31-21-14-17(15-22(32-2)23(21)33-3)20(30)8-5-9-28-10-12-29(13-11-28)19-7-4-6-18(16-19)24(25,26)27/h4,6-7,14-16H,5,8-13H2,1-3H3