(4R)-6-fluoranyl-4-(4-methylpiperazine-1,4-diium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (4R)-6-fluoranyl-4-(4-methylpiperazine-1,4-diium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (4R)-6-fluoro-4-(4-methylpiperazine-1,4-diium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (4R)-6-fluoro-4-(4-methyl-1-piperazine-1,4-diiumyl)-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (4R)-6-fluoro-4-(4-methylpiperazine-1,4-diium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (4R)-6-fluoro-4-(4-methylpiperazine-1,4-diium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C14H23FN3+3 MolecularWeight: 252.350923

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C2C[NH2+]CC3=C2C=C(C=C3)F

Isomeric SMILES

C[NH+]1CC[NH+](CC1)[C@H]2C[NH2+]CC3=C2C=C(C=C3)F

InChI

InChI=1S/C14H20FN3/c1-17-4-6-18(7-5-17)14-10-16-9-11-2-3-12(15)8-13(11)14/h2-3,8,14,16H,4-7,9-10H2,1H3/p+3/t14-/m0/s1