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

Systemtic Name: 3-[methyl(propyl)sulfonio]-4-oxidanylidene-1-(phenylmethyl)-1,8-naphthyridin-2-olate Openeye Name: 1-benzyl-3-[methyl(propyl)sulfonio]-4-oxo-1,8-naphthyridin-2-olate CAS Name: 3-[methyl(propyl)sulfonio]-4-oxo-1-(phenylmethyl)-1,8-naphthyridin-2-olate IUPAC Name: 1-benzyl-3-[methyl(propyl)sulfonio]-4-oxo-1,8-naphthyridin-2-olate Traditional Name: 1-benzyl-4-keto-3-[methyl(propyl)sulfonio]-1,8-naphthyridin-2-olate Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CCC[S+](C)C1=C(N(C2=C(C1=O)C=CC=N2)CC3=CC=CC=C3)[O-]

Isomeric SMILES

CCC[S+](C)C1=C(N(C2=C(C1=O)C=CC=N2)CC3=CC=CC=C3)[O-]

InChI

InChI=1S/C19H20N2O2S/c1-3-12-24(2)17-16(22)15-10-7-11-20-18(15)21(19(17)23)13-14-8-5-4-6-9-14/h4-11H,3,12-13H2,1-2H3