3-(4-chloranylphenoxy)propyl-methyl-[2-oxidanyl-4-oxidanylidene-1-(phenylmethyl)-1,8-naphthyridin-3-yl]sulfanium

Systemtic Name: 3-(4-chloranylphenoxy)propyl-methyl-[2-oxidanyl-4-oxidanylidene-1-(phenylmethyl)-1,8-naphthyridin-3-yl]sulfanium Openeye Name: (1-benzyl-2-hydroxy-4-oxo-1,8-naphthyridin-3-yl)-[3-(4-chlorophenoxy)propyl]-methyl-sulfonium CAS Name: 3-(4-chlorophenoxy)propyl-[2-hydroxy-4-oxo-1-(phenylmethyl)-1,8-naphthyridin-3-yl]-methylsulfonium IUPAC Name: (1-benzyl-2-hydroxy-4-oxo-1,8-naphthyridin-3-yl)-[3-(4-chlorophenoxy)propyl]-methylsulfanium Traditional Name: (1-benzyl-2-hydroxy-4-keto-1,8-naphthyridin-3-yl)-[3-(4-chlorophenoxy)propyl]-methyl-sulfonium Formula: C25H24ClN2O3S+ MolecularWeight: 467.98766

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Descriptors Computed from Structure

Canonical SMILES:

C[S+](CCCOC1=CC=C(C=C1)Cl)C2=C(N(C3=C(C2=O)C=CC=N3)CC4=CC=CC=C4)O

Isomeric SMILES

C[S+](CCCOC1=CC=C(C=C1)Cl)C2=C(N(C3=C(C2=O)C=CC=N3)CC4=CC=CC=C4)O

InChI

InChI=1S/C25H23ClN2O3S/c1-32(16-6-15-31-20-12-10-19(26)11-13-20)23-22(29)21-9-5-14-27-24(21)28(25(23)30)17-18-7-3-2-4-8-18/h2-5,7-14H,6,15-17H2,1H3/p+1