[3-(1-methylpiperazin-1-ium-1-yl)-1-phenyl-isoquinolin-4-yl]methanol

Systemtic Name: [3-(1-methylpiperazin-1-ium-1-yl)-1-phenyl-isoquinolin-4-yl]methanol Openeye Name: [3-(1-methylpiperazin-1-ium-1-yl)-1-phenyl-4-isoquinolyl]methanol CAS Name: [3-(1-methyl-1-piperazin-1-iumyl)-1-phenyl-4-isoquinolinyl]methanol IUPAC Name: [3-(1-methylpiperazin-1-ium-1-yl)-1-phenylisoquinolin-4-yl]methanol Traditional Name: [3-(1-methylpiperazin-1-ium-1-yl)-1-phenyl-4-isoquinolyl]methanol Formula: C21H24N3O+ MolecularWeight: 334.43476

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)C2=C(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CO

Isomeric SMILES

C[N+]1(CCNCC1)C2=C(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CO

InChI

InChI=1S/C21H24N3O/c1-24(13-11-22-12-14-24)21-19(15-25)17-9-5-6-10-18(17)20(23-21)16-7-3-2-4-8-16/h2-10,22,25H,11-15H2,1H3/q+1