N-[2,4-bis(fluoranyl)phenyl]-2-[4-[(2-methylphenyl)methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-2-[4-[(2-methylphenyl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,4-difluorophenyl)-2-[4-(o-tolylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,4-difluorophenyl)-2-[4-[(2-methylphenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,4-difluorophenyl)-2-[4-[(2-methylphenyl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,4-difluorophenyl)-2-[4-(2-methylbenzyl)piperazin-1-ium-1-yl]acetamide Formula: C20H24F2N3O+ MolecularWeight: 360.420866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CC[NH+](CC2)CC(=O)NC3=C(C=C(C=C3)F)F

Isomeric SMILES

CC1=CC=CC=C1CN2CC[NH+](CC2)CC(=O)NC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C20H23F2N3O/c1-15-4-2-3-5-16(15)13-24-8-10-25(11-9-24)14-20(26)23-19-7-6-17(21)12-18(19)22/h2-7,12H,8-11,13-14H2,1H3,(H,23,26)/p+1