3-fluoranyl-4-(piperazin-4-ium-1-ylmethyl)benzamide

Systemtic Name: 3-fluoranyl-4-(piperazin-4-ium-1-ylmethyl)benzamide Openeye Name: 3-fluoro-4-(piperazin-4-ium-1-ylmethyl)benzamide CAS Name: 3-fluoro-4-(1-piperazin-4-iumylmethyl)benzamide IUPAC Name: 3-fluoro-4-(piperazin-4-ium-1-ylmethyl)benzamide Traditional Name: 3-fluoro-4-(piperazin-4-ium-1-ylmethyl)benzamide Formula: C12H17FN3O+ MolecularWeight: 238.281283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=C(C=C(C=C2)C(=O)N)F

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=C(C=C(C=C2)C(=O)N)F

InChI

InChI=1S/C12H16FN3O/c13-11-7-9(12(14)17)1-2-10(11)8-16-5-3-15-4-6-16/h1-2,7,15H,3-6,8H2,(H2,14,17)/p+1