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

Systemtic Name: 6-[2-(4-ethylpyridin-1-ium-1-yl)ethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(4-ethylpyridin-1-ium-1-yl)acetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(4-ethyl-1-pyridin-1-iumyl)-1-oxoethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(4-ethylpyridin-1-ium-1-yl)acetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(4-ethylpyridin-1-ium-1-yl)acetyl]-4H-1,4-benzoxazin-3-one Formula: C17H17N2O3+ MolecularWeight: 297.32848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=[N+](C=C1)CC(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CCC1=CC=[N+](C=C1)CC(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C17H16N2O3/c1-2-12-5-7-19(8-6-12)10-15(20)13-3-4-16-14(9-13)18-17(21)11-22-16/h3-9H,2,10-11H2,1H3/p+1