[3-[4-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[4-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[4-(2-chloro-6-fluoro-benzoyl)piperazin-1-yl]-3-oxo-propyl]ammonium CAS Name: [3-[4-[(2-chloro-6-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]ammonium IUPAC Name: [3-[4-(2-chloro-6-fluorobenzoyl)piperazin-1-yl]-3-oxopropyl]azanium Traditional Name: [3-[4-(2-chloro-6-fluoro-benzoyl)piperazino]-3-keto-propyl]ammonium Formula: C14H18ClFN3O2+ MolecularWeight: 314.763023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC[NH3+])C(=O)C2=C(C=CC=C2Cl)F

Isomeric SMILES

C1CN(CCN1C(=O)CC[NH3+])C(=O)C2=C(C=CC=C2Cl)F

InChI

InChI=1S/C14H17ClFN3O2/c15-10-2-1-3-11(16)13(10)14(21)19-8-6-18(7-9-19)12(20)4-5-17/h1-3H,4-9,17H2/p+1