(2-methoxypyrimidin-5-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (2-methoxypyrimidin-5-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium Openeye Name: (2-methoxypyrimidin-5-yl)methyl-phenethyl-(4-pyridylmethyl)ammonium CAS Name: (2-methoxy-5-pyrimidinyl)methyl-phenethyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (2-methoxypyrimidin-5-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium Traditional Name: (2-methoxypyrimidin-5-yl)methyl-phenethyl-(4-pyridylmethyl)ammonium Formula: C20H23N4O+ MolecularWeight: 335.42282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=N1)C[NH+](CCC2=CC=CC=C2)CC3=CC=NC=C3

Isomeric SMILES

COC1=NC=C(C=N1)C[NH+](CCC2=CC=CC=C2)CC3=CC=NC=C3

InChI

InChI=1S/C20H22N4O/c1-25-20-22-13-19(14-23-20)16-24(15-18-7-10-21-11-8-18)12-9-17-5-3-2-4-6-17/h2-8,10-11,13-14H,9,12,15-16H2,1H3/p+1