1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(phenylmethyl)piperazine-1,4-diium

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(phenylmethyl)piperazine-1,4-diium Openeye Name: 1-benzyl-4-[(2-chloro-6-fluoro-phenyl)methyl]piperazine-1,4-diium CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-4-(phenylmethyl)piperazine-1,4-diium IUPAC Name: 1-benzyl-4-[(2-chloro-6-fluorophenyl)methyl]piperazine-1,4-diium Traditional Name: 1-benzyl-4-(2-chloro-6-fluoro-benzyl)piperazine-1,4-diium Formula: C18H22ClFN2+2 MolecularWeight: 320.832083

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H20ClFN2/c19-17-7-4-8-18(20)16(17)14-22-11-9-21(10-12-22)13-15-5-2-1-3-6-15/h1-8H,9-14H2/p+2