2-[(3,5-dimethylphenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[(3,5-dimethylphenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(3,5-dimethylphenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(3,5-dimethylphenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(3,5-dimethylphenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(3,5-dimethylphenoxy)methyl]-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C18H19N2O2+ MolecularWeight: 295.35566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)COC3=CC(=CC(=C3)C)C

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)COC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C18H18N2O2/c1-12-4-5-17-19-15(9-18(21)20(17)10-12)11-22-16-7-13(2)6-14(3)8-16/h4-10H,11H2,1-3H3/p+1