8-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]isoquinolin-7-ol

Systemtic Name: 8-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]isoquinolin-7-ol Openeye Name: 8-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]isoquinolin-7-ol CAS Name: 8-[[4-(4-fluorophenyl)-1-piperazin-1-iumyl]methyl]-7-isoquinolinol IUPAC Name: 8-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]isoquinolin-7-ol Traditional Name: 8-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]isoquinolin-7-ol Formula: C20H21FN3O+ MolecularWeight: 338.398643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC3=C2C=NC=C3)O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC3=C2C=NC=C3)O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H20FN3O/c21-16-2-4-17(5-3-16)24-11-9-23(10-12-24)14-19-18-13-22-8-7-15(18)1-6-20(19)25/h1-8,13,25H,9-12,14H2/p+1