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

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-(phenylmethyl)piperidin-1-ium Openeye Name: 4-benzyl-1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-(phenylmethyl)piperidin-1-ium IUPAC Name: 4-benzyl-1-[(3,4-dimethoxyphenyl)methyl]piperidin-1-ium Traditional Name: 4-benzyl-1-veratryl-piperidin-1-ium Formula: C21H28NO2+ MolecularWeight: 326.45252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CCC(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CCC(CC2)CC3=CC=CC=C3)OC

InChI

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