[4-(2-phenoxyethyl)-1-[(2,4,6-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanol

Systemtic Name: [4-(2-phenoxyethyl)-1-[(2,4,6-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanol Openeye Name: [4-(2-phenoxyethyl)-1-[(2,4,6-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanol CAS Name: [4-(2-phenoxyethyl)-1-[(2,4,6-trimethoxyphenyl)methyl]-4-piperidin-1-iumyl]methanol IUPAC Name: [4-(2-phenoxyethyl)-1-[(2,4,6-trimethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanol Traditional Name: [4-(2-phenoxyethyl)-1-(2,4,6-trimethoxybenzyl)piperidin-1-ium-4-yl]methanol Formula: C24H34NO5+ MolecularWeight: 416.53046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)C[NH+]2CCC(CC2)(CCOC3=CC=CC=C3)CO)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)C[NH+]2CCC(CC2)(CCOC3=CC=CC=C3)CO)OC

InChI

InChI=1S/C24H33NO5/c1-27-20-15-22(28-2)21(23(16-20)29-3)17-25-12-9-24(18-26,10-13-25)11-14-30-19-7-5-4-6-8-19/h4-8,15-16,26H,9-14,17-18H2,1-3H3/p+1