5-(3-methoxyphenyl)-4-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-2-pyridin-4-yl-pyrimidine

Systemtic Name: 5-(3-methoxyphenyl)-4-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-2-pyridin-4-yl-pyrimidine Openeye Name: 5-(3-methoxyphenyl)-4-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-2-(4-pyridyl)pyrimidine CAS Name: 5-(3-methoxyphenyl)-4-[1-(3-phenylpropyl)-4-piperidin-1-iumyl]-2-pyridin-4-ylpyrimidine IUPAC Name: 5-(3-methoxyphenyl)-4-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-2-pyridin-4-ylpyrimidine Traditional Name: 5-(3-methoxyphenyl)-4-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]-2-(4-pyridyl)pyrimidine Formula: C30H33N4O+ MolecularWeight: 465.60922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CN=C(N=C2C3CC[NH+](CC3)CCCC4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C2=CN=C(N=C2C3CC[NH+](CC3)CCCC4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C30H32N4O/c1-35-27-11-5-10-26(21-27)28-22-32-30(25-12-16-31-17-13-25)33-29(28)24-14-19-34(20-15-24)18-6-9-23-7-3-2-4-8-23/h2-5,7-8,10-13,16-17,21-22,24H,6,9,14-15,18-20H2,1H3/p+1