[3,4-bis(fluoranyl)phenyl]-(4-piperazin-4-ium-1-ylpiperidin-1-yl)methanone

Systemtic Name: [3,4-bis(fluoranyl)phenyl]-(4-piperazin-4-ium-1-ylpiperidin-1-yl)methanone Openeye Name: (3,4-difluorophenyl)-(4-piperazin-4-ium-1-yl-1-piperidyl)methanone CAS Name: (3,4-difluorophenyl)-[4-(1-piperazin-4-iumyl)-1-piperidinyl]methanone IUPAC Name: (3,4-difluorophenyl)-(4-piperazin-4-ium-1-ylpiperidin-1-yl)methanone Traditional Name: (3,4-difluorophenyl)-(4-piperazin-4-ium-1-ylpiperidino)methanone Formula: C16H22F2N3O+ MolecularWeight: 310.362186

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CC[NH2+]CC2)C(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

C1CN(CCC1N2CC[NH2+]CC2)C(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C16H21F2N3O/c17-14-2-1-12(11-15(14)18)16(22)21-7-3-13(4-8-21)20-9-5-19-6-10-20/h1-2,11,13,19H,3-10H2/p+1