N-cyclohexyl-N-[(4-fluorophenyl)methyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclohexyl-N-[(4-fluorophenyl)methyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclohexyl-N-[(4-fluorophenyl)methyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclohexyl-N-[(4-fluorophenyl)methyl]-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclohexyl-N-[(4-fluorophenyl)methyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclohexyl-N-(4-fluorobenzyl)-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Formula: C25H33FN3O2+ MolecularWeight: 426.546823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=C(C=C2)F)C(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=C(C=C2)F)C(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C25H32FN3O2/c26-21-8-6-20(7-9-21)18-29(23-4-2-1-3-5-23)25(31)19-27-14-16-28(17-15-27)22-10-12-24(30)13-11-22/h6-13,23,30H,1-5,14-19H2/p+1