6,7-dimethoxy-2-[(3-phenylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-2-[(3-phenylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 6,7-dimethoxy-2-[(3-phenylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one CAS Name: 6,7-dimethoxy-2-[(3-phenyl-1-pyridin-1-iumyl)methyl]-1H-quinazolin-4-one IUPAC Name: 6,7-dimethoxy-2-[(3-phenylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[(3-phenylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Formula: C22H20N3O3+ MolecularWeight: 374.4125

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)C[N+]3=CC=CC(=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)C[N+]3=CC=CC(=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H19N3O3/c1-27-19-11-17-18(12-20(19)28-2)23-21(24-22(17)26)14-25-10-6-9-16(13-25)15-7-4-3-5-8-15/h3-13H,14H2,1-2H3/p+1