2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-6-pyridin-2-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-6-pyridin-2-yl-1H-pyrimidin-4-one Openeye Name: 2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-6-(2-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-[4-(4-morpholin-4-iumylmethyl)phenyl]-6-(2-pyridinyl)-1H-pyrimidin-4-one IUPAC Name: 2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-6-pyridin-2-yl-1H-pyrimidin-4-one Traditional Name: 2-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-6-(2-pyridyl)-1H-pyrimidin-4-one Formula: C20H21N4O2+ MolecularWeight: 349.40634

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)C4=CC=CC=N4

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)C4=CC=CC=N4

InChI

InChI=1S/C20H20N4O2/c25-19-13-18(17-3-1-2-8-21-17)22-20(23-19)16-6-4-15(5-7-16)14-24-9-11-26-12-10-24/h1-8,13H,9-12,14H2,(H,22,23,25)/p+1