N-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-cyclohexylpiperazin-1-yl)-2-(2-methoxyphenyl)ethanamine

Systemtic Name: N-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-cyclohexylpiperazin-1-yl)-2-(2-methoxyphenyl)ethanamine Openeye Name: N-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-cyclohexylpiperazin-1-yl)-2-(2-methoxyphenyl)ethanamine CAS Name: N-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-cyclohexyl-1-piperazinyl)-2-(2-methoxyphenyl)ethanamine IUPAC Name: N-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl]-2-(4-cyclohexylpiperazin-1-yl)-2-(2-methoxyphenyl)ethanamine Traditional Name: 2-[3,5-bis(trifluoromethyl)phenyl]ethyl-[2-(4-cyclohexylpiperazino)-2-(2-methoxyphenyl)ethyl]amine Formula: C29H37F6N3O MolecularWeight: 557.613999

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNCCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1C(CNCCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C29H37F6N3O/c1-39-27-10-6-5-9-25(27)26(38-15-13-37(14-16-38)24-7-3-2-4-8-24)20-36-12-11-21-17-22(28(30,31)32)19-23(18-21)29(33,34)35/h5-6,9-10,17-19,24,26,36H,2-4,7-8,11-16,20H2,1H3