3-[methyl(2-phenylmethoxyethyl)sulfonio]-4-oxidanylidene-1-(phenylmethyl)-1,8-naphthyridin-2-olate

Systemtic Name: 3-[methyl(2-phenylmethoxyethyl)sulfonio]-4-oxidanylidene-1-(phenylmethyl)-1,8-naphthyridin-2-olate Openeye Name: 1-benzyl-3-[2-benzyloxyethyl(methyl)sulfonio]-4-oxo-1,8-naphthyridin-2-olate CAS Name: 3-[methyl(2-phenylmethoxyethyl)sulfonio]-4-oxo-1-(phenylmethyl)-1,8-naphthyridin-2-olate IUPAC Name: 1-benzyl-3-[methyl(2-phenylmethoxyethyl)sulfonio]-4-oxo-1,8-naphthyridin-2-olate Traditional Name: 3-[2-benzoxyethyl(methyl)sulfonio]-1-benzyl-4-keto-1,8-naphthyridin-2-olate Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](CCOCC1=CC=CC=C1)C2=C(N(C3=C(C2=O)C=CC=N3)CC4=CC=CC=C4)[O-]

Isomeric SMILES

C[S+](CCOCC1=CC=CC=C1)C2=C(N(C3=C(C2=O)C=CC=N3)CC4=CC=CC=C4)[O-]

InChI

InChI=1S/C25H24N2O3S/c1-31(16-15-30-18-20-11-6-3-7-12-20)23-22(28)21-13-8-14-26-24(21)27(25(23)29)17-19-9-4-2-5-10-19/h2-14H,15-18H2,1H3