(4-methoxyphenyl)-[1-[(7-oxidanylisoquinolin-8-yl)methyl]piperidin-1-ium-4-yl]methanone

Systemtic Name: (4-methoxyphenyl)-[1-[(7-oxidanylisoquinolin-8-yl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: [1-[(7-hydroxy-8-isoquinolyl)methyl]piperidin-1-ium-4-yl]-(4-methoxyphenyl)methanone CAS Name: [1-[(7-hydroxy-8-isoquinolinyl)methyl]-4-piperidin-1-iumyl]-(4-methoxyphenyl)methanone IUPAC Name: [1-[(7-hydroxyisoquinolin-8-yl)methyl]piperidin-1-ium-4-yl]-(4-methoxyphenyl)methanone Traditional Name: [1-[(7-hydroxy-8-isoquinolyl)methyl]piperidin-1-ium-4-yl]-(4-methoxyphenyl)methanone Formula: C23H25N2O3+ MolecularWeight: 377.4562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)CC3=C(C=CC4=C3C=NC=C4)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2CC[NH+](CC2)CC3=C(C=CC4=C3C=NC=C4)O

InChI

InChI=1S/C23H24N2O3/c1-28-19-5-2-17(3-6-19)23(27)18-9-12-25(13-10-18)15-21-20-14-24-11-8-16(20)4-7-22(21)26/h2-8,11,14,18,26H,9-10,12-13,15H2,1H3/p+1