2-[4-[3,4-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]ethylazanium

Systemtic Name: 2-[4-[3,4-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]ethylazanium Openeye Name: 2-[4-(3,4-difluorobenzoyl)piperazin-1-yl]ethylammonium CAS Name: 2-[4-[(3,4-difluorophenyl)-oxomethyl]-1-piperazinyl]ethylammonium IUPAC Name: 2-[4-(3,4-difluorobenzoyl)piperazin-1-yl]ethylazanium Traditional Name: 2-[4-(3,4-difluorobenzoyl)piperazino]ethylammonium Formula: C13H18F2N3O+ MolecularWeight: 270.298326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC[NH3+])C(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

C1CN(CCN1CC[NH3+])C(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C13H17F2N3O/c14-11-2-1-10(9-12(11)15)13(19)18-7-5-17(4-3-16)6-8-18/h1-2,9H,3-8,16H2/p+1