3-[4-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperazin-1-yl]propylazanium

Systemtic Name: 3-[4-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperazin-1-yl]propylazanium Openeye Name: 3-[4-(2-chloro-6-fluoro-benzoyl)piperazin-1-yl]propylammonium CAS Name: 3-[4-[(2-chloro-6-fluorophenyl)-oxomethyl]-1-piperazinyl]propylammonium IUPAC Name: 3-[4-(2-chloro-6-fluorobenzoyl)piperazin-1-yl]propylazanium Traditional Name: 3-[4-(2-chloro-6-fluoro-benzoyl)piperazino]propylammonium Formula: C14H20ClFN3O+ MolecularWeight: 300.779503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC[NH3+])C(=O)C2=C(C=CC=C2Cl)F

Isomeric SMILES

C1CN(CCN1CCC[NH3+])C(=O)C2=C(C=CC=C2Cl)F

InChI

InChI=1S/C14H19ClFN3O/c15-11-3-1-4-12(16)13(11)14(20)19-9-7-18(8-10-19)6-2-5-17/h1,3-4H,2,5-10,17H2/p+1