(3,5-dimethoxyphenyl)methyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: (3,5-dimethoxyphenyl)methyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[(3,5-dimethoxyphenyl)methyl]ammonium CAS Name: (3,5-dimethoxyphenyl)methyl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[(3,5-dimethoxyphenyl)methyl]azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(3,5-dimethoxybenzyl)ammonium Formula: C21H30N2O2+2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C[NH2+]C2CC[NH+](CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C[NH2+]C2CC[NH+](CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C21H28N2O2/c1-24-20-12-18(13-21(14-20)25-2)15-22-19-8-10-23(11-9-19)16-17-6-4-3-5-7-17/h3-7,12-14,19,22H,8-11,15-16H2,1-2H3/p+2