N-(4-fluorophenyl)-3-methyl-4-piperazin-4-ium-1-yl-benzamide

Systemtic Name: N-(4-fluorophenyl)-3-methyl-4-piperazin-4-ium-1-yl-benzamide Openeye Name: N-(4-fluorophenyl)-3-methyl-4-piperazin-4-ium-1-yl-benzamide CAS Name: N-(4-fluorophenyl)-3-methyl-4-(1-piperazin-4-iumyl)benzamide IUPAC Name: N-(4-fluorophenyl)-3-methyl-4-piperazin-4-ium-1-ylbenzamide Traditional Name: N-(4-fluorophenyl)-3-methyl-4-piperazin-4-ium-1-yl-benzamide Formula: C18H21FN3O+ MolecularWeight: 314.377243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)F)N3CC[NH2+]CC3

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)F)N3CC[NH2+]CC3

InChI

InChI=1S/C18H20FN3O/c1-13-12-14(2-7-17(13)22-10-8-20-9-11-22)18(23)21-16-5-3-15(19)4-6-16/h2-7,12,20H,8-11H2,1H3,(H,21,23)/p+1