[1-(isoquinolin-5-ylmethyl)-4-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methanol

Systemtic Name: [1-(isoquinolin-5-ylmethyl)-4-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methanol Openeye Name: [1-(5-isoquinolylmethyl)-4-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methanol CAS Name: [1-(5-isoquinolinylmethyl)-4-[(4-methoxyphenyl)methyl]-4-piperidin-1-iumyl]methanol IUPAC Name: [1-(isoquinolin-5-ylmethyl)-4-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methanol Traditional Name: [1-(5-isoquinolylmethyl)-4-p-anisyl-piperidin-1-ium-4-yl]methanol Formula: C24H29N2O2+ MolecularWeight: 377.49926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2(CC[NH+](CC2)CC3=CC=CC4=C3C=CN=C4)CO

Isomeric SMILES

COC1=CC=C(C=C1)CC2(CC[NH+](CC2)CC3=CC=CC4=C3C=CN=C4)CO

InChI

InChI=1S/C24H28N2O2/c1-28-22-7-5-19(6-8-22)15-24(18-27)10-13-26(14-11-24)17-21-4-2-3-20-16-25-12-9-23(20)21/h2-9,12,16,27H,10-11,13-15,17-18H2,1H3/p+1