3-ethanoyl-1-[3-[1-oxidanyl-6-(2-oxidanylpropan-2-yl)pyridin-1-ium-3-yl]phenyl]-1,8-naphthyridin-4-one

Systemtic Name: 3-ethanoyl-1-[3-[1-oxidanyl-6-(2-oxidanylpropan-2-yl)pyridin-1-ium-3-yl]phenyl]-1,8-naphthyridin-4-one Openeye Name: 3-acetyl-1-[3-[1-hydroxy-6-(1-hydroxy-1-methyl-ethyl)pyridin-1-ium-3-yl]phenyl]-1,8-naphthyridin-4-one CAS Name: 3-acetyl-1-[3-[1-hydroxy-6-(2-hydroxypropan-2-yl)-3-pyridin-1-iumyl]phenyl]-1,8-naphthyridin-4-one IUPAC Name: 3-acetyl-1-[3-[1-hydroxy-6-(2-hydroxypropan-2-yl)pyridin-1-ium-3-yl]phenyl]-1,8-naphthyridin-4-one Traditional Name: 3-acetyl-1-[3-[1-hydroxy-6-(1-hydroxy-1-methyl-ethyl)pyridin-1-ium-3-yl]phenyl]-1,8-naphthyridin-4-one Formula: C24H22N3O4+ MolecularWeight: 416.44918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C2=C(C1=O)C=CC=N2)C3=CC=CC(=C3)C4=C[N+](=C(C=C4)C(C)(C)O)O

Isomeric SMILES

CC(=O)C1=CN(C2=C(C1=O)C=CC=N2)C3=CC=CC(=C3)C4=C[N+](=C(C=C4)C(C)(C)O)O

InChI

InChI=1S/C24H22N3O4/c1-15(28)20-14-26(23-19(22(20)29)8-5-11-25-23)18-7-4-6-16(12-18)17-9-10-21(24(2,3)30)27(31)13-17/h4-14,30-31H,1-3H3/q+1