7-chloranyl-2-[(3-ethanoylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(3-ethanoylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 2-[(3-acetylpyridin-1-ium-1-yl)methyl]-7-chloro-1H-quinazolin-4-one CAS Name: 2-[(3-acetyl-1-pyridin-1-iumyl)methyl]-7-chloro-1H-quinazolin-4-one IUPAC Name: 2-[(3-acetylpyridin-1-ium-1-yl)methyl]-7-chloro-1H-quinazolin-4-one Traditional Name: 2-[(3-acetylpyridin-1-ium-1-yl)methyl]-7-chloro-1H-quinazolin-4-one Formula: C16H13ClN3O2+ MolecularWeight: 314.74632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C[N+](=CC=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC(=O)C1=C[N+](=CC=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C16H12ClN3O2/c1-10(21)11-3-2-6-20(8-11)9-15-18-14-7-12(17)4-5-13(14)16(22)19-15/h2-8H,9H2,1H3/p+1