[1-ethyl-4-(1-phenylisoquinolin-3-yl)piperazin-1-ium-1-yl]methanol

Systemtic Name: [1-ethyl-4-(1-phenylisoquinolin-3-yl)piperazin-1-ium-1-yl]methanol Openeye Name: [1-ethyl-4-(1-phenyl-3-isoquinolyl)piperazin-1-ium-1-yl]methanol CAS Name: [1-ethyl-4-(1-phenyl-3-isoquinolinyl)-1-piperazin-1-iumyl]methanol IUPAC Name: [1-ethyl-4-(1-phenylisoquinolin-3-yl)piperazin-1-ium-1-yl]methanol Traditional Name: [1-ethyl-4-(1-phenyl-3-isoquinolyl)piperazin-1-ium-1-yl]methanol Formula: C22H26N3O+ MolecularWeight: 348.46134

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCN(CC1)C2=CC3=CC=CC=C3C(=N2)C4=CC=CC=C4)CO

Isomeric SMILES

CC[N+]1(CCN(CC1)C2=CC3=CC=CC=C3C(=N2)C4=CC=CC=C4)CO

InChI

InChI=1S/C22H26N3O/c1-2-25(17-26)14-12-24(13-15-25)21-16-19-10-6-7-11-20(19)22(23-21)18-8-4-3-5-9-18/h3-11,16,26H,2,12-15,17H2,1H3/q+1