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

Systemtic Name: 2-methoxy-4-methyl-6-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]phenol Openeye Name: 2-[(4-benzylpiperidin-1-ium-1-yl)methyl]-6-methoxy-4-methyl-phenol CAS Name: 2-methoxy-4-methyl-6-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]phenol IUPAC Name: 2-[(4-benzylpiperidin-1-ium-1-yl)methyl]-6-methoxy-4-methylphenol Traditional Name: 2-[(4-benzylpiperidin-1-ium-1-yl)methyl]-6-methoxy-4-methyl-phenol Formula: C21H28NO2+ MolecularWeight: 326.45252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC)O)C[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C(=C1)OC)O)C[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H27NO2/c1-16-12-19(21(23)20(13-16)24-2)15-22-10-8-18(9-11-22)14-17-6-4-3-5-7-17/h3-7,12-13,18,23H,8-11,14-15H2,1-2H3/p+1