ethyl 4-oxidanylidene-1-[3-[1-oxidanyl-6-(2-oxidanylpropan-2-yl)pyridin-1-ium-3-yl]phenyl]-1,8-naphthyridine-3-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-1-[3-[1-oxidanyl-6-(2-oxidanylpropan-2-yl)pyridin-1-ium-3-yl]phenyl]-1,8-naphthyridine-3-carboxylate Openeye Name: ethyl 1-[3-[1-hydroxy-6-(1-hydroxy-1-methyl-ethyl)pyridin-1-ium-3-yl]phenyl]-4-oxo-1,8-naphthyridine-3-carboxylate CAS Name: 1-[3-[1-hydroxy-6-(2-hydroxypropan-2-yl)-3-pyridin-1-iumyl]phenyl]-4-oxo-1,8-naphthyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[1-hydroxy-6-(2-hydroxypropan-2-yl)pyridin-1-ium-3-yl]phenyl]-4-oxo-1,8-naphthyridine-3-carboxylate Traditional Name: 1-[3-[1-hydroxy-6-(1-hydroxy-1-methyl-ethyl)pyridin-1-ium-3-yl]phenyl]-4-keto-1,8-naphthyridine-3-carboxylic acid ethyl ester Formula: C25H24N3O5+ MolecularWeight: 446.47516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=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

CCOC(=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/C25H24N3O5/c1-4-33-24(30)20-15-27(23-19(22(20)29)9-6-12-26-23)18-8-5-7-16(13-18)17-10-11-21(25(2,3)31)28(32)14-17/h5-15,31-32H,4H2,1-3H3/q+1