1-cyclopropyl-3-[methyl-[2-(3,4,5-trimethoxyphenoxy)ethyl]sulfonio]-4-oxidanylidene-1,8-naphthyridin-2-olate

Systemtic Name: 1-cyclopropyl-3-[methyl-[2-(3,4,5-trimethoxyphenoxy)ethyl]sulfonio]-4-oxidanylidene-1,8-naphthyridin-2-olate Openeye Name: 1-cyclopropyl-3-[methyl-[2-(3,4,5-trimethoxyphenoxy)ethyl]sulfonio]-4-oxo-1,8-naphthyridin-2-olate CAS Name: 1-cyclopropyl-3-[methyl-[2-(3,4,5-trimethoxyphenoxy)ethyl]sulfonio]-4-oxo-1,8-naphthyridin-2-olate IUPAC Name: 1-cyclopropyl-3-[methyl-[2-(3,4,5-trimethoxyphenoxy)ethyl]sulfonio]-4-oxo-1,8-naphthyridin-2-olate Traditional Name: 1-cyclopropyl-4-keto-3-[methyl-[2-(3,4,5-trimethoxyphenoxy)ethyl]sulfonio]-1,8-naphthyridin-2-olate Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)OCC[S+](C)C2=C(N(C3=C(C2=O)C=CC=N3)C4CC4)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)OCC[S+](C)C2=C(N(C3=C(C2=O)C=CC=N3)C4CC4)[O-]

InChI

InChI=1S/C23H26N2O6S/c1-28-17-12-15(13-18(29-2)20(17)30-3)31-10-11-32(4)21-19(26)16-6-5-9-24-22(16)25(23(21)27)14-7-8-14/h5-6,9,12-14H,7-8,10-11H2,1-4H3