4-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-5-(3-methylphenyl)-2-pyridin-4-yl-pyrimidine

Systemtic Name: 4-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-5-(3-methylphenyl)-2-pyridin-4-yl-pyrimidine Openeye Name: 4-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-5-(m-tolyl)-2-(4-pyridyl)pyrimidine CAS Name: 4-[1-[(2,5-dimethoxyphenyl)methyl]-4-piperidin-1-iumyl]-5-(3-methylphenyl)-2-pyridin-4-ylpyrimidine IUPAC Name: 4-[1-[(2,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-5-(3-methylphenyl)-2-pyridin-4-ylpyrimidine Traditional Name: 4-[1-(2,5-dimethoxybenzyl)piperidin-1-ium-4-yl]-5-(m-tolyl)-2-(4-pyridyl)pyrimidine Formula: C30H33N4O2+ MolecularWeight: 481.60862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CN=C(N=C2C3CC[NH+](CC3)CC4=C(C=CC(=C4)OC)OC)C5=CC=NC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C2=CN=C(N=C2C3CC[NH+](CC3)CC4=C(C=CC(=C4)OC)OC)C5=CC=NC=C5

InChI

InChI=1S/C30H32N4O2/c1-21-5-4-6-24(17-21)27-19-32-30(23-9-13-31-14-10-23)33-29(27)22-11-15-34(16-12-22)20-25-18-26(35-2)7-8-28(25)36-3/h4-10,13-14,17-19,22H,11-12,15-16,20H2,1-3H3/p+1