[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-methyl-(phenylmethyl)azanium

Systemtic Name: [1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-methyl-ammonium CAS Name: [1-[(4-methoxyphenyl)methyl]-4-piperidin-1-iumyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]-methylazanium Traditional Name: benzyl-methyl-(1-p-anisylpiperidin-1-ium-4-yl)ammonium Formula: C21H30N2O+2 MolecularWeight: 326.4757

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C2CC[NH+](CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)C2CC[NH+](CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H28N2O/c1-22(16-18-6-4-3-5-7-18)20-12-14-23(15-13-20)17-19-8-10-21(24-2)11-9-19/h3-11,20H,12-17H2,1-2H3/p+2