6-[2-(3-phenylpyridin-1-ium-1-yl)ethanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(3-phenylpyridin-1-ium-1-yl)ethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3-phenylpyridin-1-ium-1-yl)acetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-oxo-2-(3-phenyl-1-pyridin-1-iumyl)ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3-phenylpyridin-1-ium-1-yl)acetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(3-phenylpyridin-1-ium-1-yl)acetyl]-4H-1,4-benzoxazin-3-one Formula: C21H17N2O3+ MolecularWeight: 345.37128

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)C[N+]3=CC=CC(=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)C[N+]3=CC=CC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O3/c24-19(16-8-9-20-18(11-16)22-21(25)14-26-20)13-23-10-4-7-17(12-23)15-5-2-1-3-6-15/h1-12H,13-14H2/p+1