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

Systemtic Name: 3-[3-(4-chloranylphenoxy)propyl-methyl-sulfonio]-4-oxidanylidene-1-(phenylmethyl)-1,8-naphthyridin-2-olate Openeye Name: 1-benzyl-3-[3-(4-chlorophenoxy)propyl-methyl-sulfonio]-4-oxo-1,8-naphthyridin-2-olate CAS Name: 3-[3-(4-chlorophenoxy)propyl-methylsulfonio]-4-oxo-1-(phenylmethyl)-1,8-naphthyridin-2-olate IUPAC Name: 1-benzyl-3-[3-(4-chlorophenoxy)propyl-methylsulfonio]-4-oxo-1,8-naphthyridin-2-olate Traditional Name: 1-benzyl-3-[3-(4-chlorophenoxy)propyl-methyl-sulfonio]-4-keto-1,8-naphthyridin-2-olate Formula: C25H23ClN2O3S MolecularWeight: 466.97972

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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