methyl-[(7-oxidanylisoquinolin-8-yl)methyl]-[(2-piperidin-1-ylphenyl)methyl]azanium

Systemtic Name: methyl-[(7-oxidanylisoquinolin-8-yl)methyl]-[(2-piperidin-1-ylphenyl)methyl]azanium Openeye Name: (7-hydroxy-8-isoquinolyl)methyl-methyl-[[2-(1-piperidyl)phenyl]methyl]ammonium CAS Name: (7-hydroxy-8-isoquinolinyl)methyl-methyl-[[2-(1-piperidinyl)phenyl]methyl]ammonium IUPAC Name: (7-hydroxyisoquinolin-8-yl)methyl-methyl-[(2-piperidin-1-ylphenyl)methyl]azanium Traditional Name: (7-hydroxy-8-isoquinolyl)methyl-methyl-(2-piperidinobenzyl)ammonium Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1N2CCCCC2)CC3=C(C=CC4=C3C=NC=C4)O

Isomeric SMILES

C[NH+](CC1=CC=CC=C1N2CCCCC2)CC3=C(C=CC4=C3C=NC=C4)O

InChI

InChI=1S/C23H27N3O/c1-25(17-21-20-15-24-12-11-18(20)9-10-23(21)27)16-19-7-3-4-8-22(19)26-13-5-2-6-14-26/h3-4,7-12,15,27H,2,5-6,13-14,16-17H2,1H3/p+1