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

Systemtic Name: 1-[[2,4-bis(oxidanylidene)-1-(phenylmethyl)-1,8-naphthyridin-3-yl]-methyl-sulfonio]propan-2-olate Openeye Name: 1-[(1-benzyl-2,4-dioxo-1,8-naphthyridin-3-yl)-methyl-sulfonio]propan-2-olate CAS Name: 1-[[2,4-dioxo-1-(phenylmethyl)-1,8-naphthyridin-3-yl]-methylsulfonio]-2-propanolate IUPAC Name: 1-[(1-benzyl-2,4-dioxo-1,8-naphthyridin-3-yl)-methylsulfonio]propan-2-olate Traditional Name: 1-[(1-benzyl-2,4-diketo-1,8-naphthyridin-3-yl)-methyl-sulfonio]propan-2-olate Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[S+](C)C1C(=O)C2=C(N=CC=C2)N(C1=O)CC3=CC=CC=C3)[O-]

Isomeric SMILES

CC(C[S+](C)C1C(=O)C2=C(N=CC=C2)N(C1=O)CC3=CC=CC=C3)[O-]

InChI

InChI=1S/C19H20N2O3S/c1-13(22)12-25(2)17-16(23)15-9-6-10-20-18(15)21(19(17)24)11-14-7-4-3-5-8-14/h3-10,13,17H,11-12H2,1-2H3