N-(4-fluorophenyl)-2-piperazin-4-ium-1-yl-benzamide

Systemtic Name: N-(4-fluorophenyl)-2-piperazin-4-ium-1-yl-benzamide Openeye Name: N-(4-fluorophenyl)-2-piperazin-4-ium-1-yl-benzamide CAS Name: N-(4-fluorophenyl)-2-(1-piperazin-4-iumyl)benzamide IUPAC Name: N-(4-fluorophenyl)-2-piperazin-4-ium-1-ylbenzamide Traditional Name: N-(4-fluorophenyl)-2-piperazin-4-ium-1-yl-benzamide Formula: C17H19FN3O+ MolecularWeight: 300.350663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C17H18FN3O/c18-13-5-7-14(8-6-13)20-17(22)15-3-1-2-4-16(15)21-11-9-19-10-12-21/h1-8,19H,9-12H2,(H,20,22)/p+1