2-ethoxy-6-[[4-(hydroxymethyl)-4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2-ethoxy-6-[[4-(hydroxymethyl)-4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]phenol Openeye Name: 2-[[4-benzyl-4-(hydroxymethyl)piperidin-1-ium-1-yl]methyl]-6-ethoxy-phenol CAS Name: 2-ethoxy-6-[[4-(hydroxymethyl)-4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]phenol IUPAC Name: 2-[[4-benzyl-4-(hydroxymethyl)piperidin-1-ium-1-yl]methyl]-6-ethoxyphenol Traditional Name: 2-[(4-benzyl-4-methylol-piperidin-1-ium-1-yl)methyl]-6-ethoxy-phenol Formula: C22H30NO3+ MolecularWeight: 356.4785

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C[NH+]2CCC(CC2)(CC3=CC=CC=C3)CO

Isomeric SMILES

CCOC1=CC=CC(=C1O)C[NH+]2CCC(CC2)(CC3=CC=CC=C3)CO

InChI

InChI=1S/C22H29NO3/c1-2-26-20-10-6-9-19(21(20)25)16-23-13-11-22(17-24,12-14-23)15-18-7-4-3-5-8-18/h3-10,24-25H,2,11-17H2,1H3/p+1