2-[3-[[4-(hydroxymethyl)-4-(2-phenoxyethyl)piperidin-1-ium-1-yl]methyl]phenoxy]ethanol

Systemtic Name: 2-[3-[[4-(hydroxymethyl)-4-(2-phenoxyethyl)piperidin-1-ium-1-yl]methyl]phenoxy]ethanol Openeye Name: 2-[3-[[4-(hydroxymethyl)-4-(2-phenoxyethyl)piperidin-1-ium-1-yl]methyl]phenoxy]ethanol CAS Name: 2-[3-[[4-(hydroxymethyl)-4-(2-phenoxyethyl)-1-piperidin-1-iumyl]methyl]phenoxy]ethanol IUPAC Name: 2-[3-[[4-(hydroxymethyl)-4-(2-phenoxyethyl)piperidin-1-ium-1-yl]methyl]phenoxy]ethanol Traditional Name: 2-[3-[[4-methylol-4-(2-phenoxyethyl)piperidin-1-ium-1-yl]methyl]phenoxy]ethanol Formula: C23H32NO4+ MolecularWeight: 386.50448

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(CCOC2=CC=CC=C2)CO)CC3=CC(=CC=C3)OCCO

Isomeric SMILES

C1C[NH+](CCC1(CCOC2=CC=CC=C2)CO)CC3=CC(=CC=C3)OCCO

InChI

InChI=1S/C23H31NO4/c25-14-16-28-22-8-4-5-20(17-22)18-24-12-9-23(19-26,10-13-24)11-15-27-21-6-2-1-3-7-21/h1-8,17,25-26H,9-16,18-19H2/p+1