2-[4-(4-phenylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(4-phenylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(4-phenylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(4-phenyl-2-quinolin-1-iumyl)-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(4-phenylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(4-phenylquinolin-1-ium-2-yl)piperazin-1-ium-1-yl]ethanol Formula: C21H25N3O+2 MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCO)C2=[NH+]C3=CC=CC=C3C(=C2)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCO)C2=[NH+]C3=CC=CC=C3C(=C2)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O/c25-15-14-23-10-12-24(13-11-23)21-16-19(17-6-2-1-3-7-17)18-8-4-5-9-20(18)22-21/h1-9,16,25H,10-15H2/p+2