2-(2,6-dimethyl-4-oxidanylidene-5-phenyl-pyrimidin-1-yl)ethyl-diethyl-azanium

Systemtic Name: 2-(2,6-dimethyl-4-oxidanylidene-5-phenyl-pyrimidin-1-yl)ethyl-diethyl-azanium Openeye Name: 2-(2,6-dimethyl-4-oxo-5-phenyl-pyrimidin-1-yl)ethyl-diethyl-ammonium CAS Name: 2-(2,6-dimethyl-4-oxo-5-phenyl-1-pyrimidinyl)ethyl-diethylammonium IUPAC Name: 2-(2,6-dimethyl-4-oxo-5-phenylpyrimidin-1-yl)ethyl-diethylazanium Traditional Name: diethyl-[2-(4-keto-2,6-dimethyl-5-phenyl-pyrimidin-1-yl)ethyl]ammonium Formula: C18H26N3O+ MolecularWeight: 300.41854

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(=C(C(=O)N=C1C)C2=CC=CC=C2)C

Isomeric SMILES

CC[NH+](CC)CCN1C(=C(C(=O)N=C1C)C2=CC=CC=C2)C

InChI

InChI=1S/C18H25N3O/c1-5-20(6-2)12-13-21-14(3)17(18(22)19-15(21)4)16-10-8-7-9-11-16/h7-11H,5-6,12-13H2,1-4H3/p+1