2-(1,3-benzodioxol-5-ylmethoxy)ethyl-methyl-[2-oxidanyl-4-oxidanylidene-1-(phenylmethyl)-1,8-naphthyridin-3-yl]sulfanium

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethoxy)ethyl-methyl-[2-oxidanyl-4-oxidanylidene-1-(phenylmethyl)-1,8-naphthyridin-3-yl]sulfanium Openeye Name: 2-(1,3-benzodioxol-5-ylmethoxy)ethyl-(1-benzyl-2-hydroxy-4-oxo-1,8-naphthyridin-3-yl)-methyl-sulfonium CAS Name: 2-(1,3-benzodioxol-5-ylmethoxy)ethyl-[2-hydroxy-4-oxo-1-(phenylmethyl)-1,8-naphthyridin-3-yl]-methylsulfonium IUPAC Name: 2-(1,3-benzodioxol-5-ylmethoxy)ethyl-(1-benzyl-2-hydroxy-4-oxo-1,8-naphthyridin-3-yl)-methylsulfanium Traditional Name: (1-benzyl-2-hydroxy-4-keto-1,8-naphthyridin-3-yl)-methyl-(2-piperonyloxyethyl)sulfonium Formula: C26H25N2O5S+ MolecularWeight: 477.5521

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](CCOCC1=CC2=C(C=C1)OCO2)C3=C(N(C4=C(C3=O)C=CC=N4)CC5=CC=CC=C5)O

Isomeric SMILES

C[S+](CCOCC1=CC2=C(C=C1)OCO2)C3=C(N(C4=C(C3=O)C=CC=N4)CC5=CC=CC=C5)O

InChI

InChI=1S/C26H24N2O5S/c1-34(13-12-31-16-19-9-10-21-22(14-19)33-17-32-21)24-23(29)20-8-5-11-27-25(20)28(26(24)30)15-18-6-3-2-4-7-18/h2-11,14H,12-13,15-17H2,1H3/p+1