4-[4-(hydroxymethyl)-2-oxidanylidene-7-thiophen-3-yl-1H-1,5-naphthyridin-3-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(hydroxymethyl)-2-oxidanylidene-7-thiophen-3-yl-1H-1,5-naphthyridin-3-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(hydroxymethyl)-2-oxo-7-(3-thienyl)-1H-1,5-naphthyridin-3-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(hydroxymethyl)-2-oxo-7-(3-thiophenyl)-1H-1,5-naphthyridin-3-yl]-4-oxobutanoic acid IUPAC Name: 4-[4-(hydroxymethyl)-2-oxo-7-thiophen-3-yl-1H-1,5-naphthyridin-3-yl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[2-keto-4-methylol-7-(3-thienyl)-1H-1,5-naphthyridin-3-yl]butyric acid Formula: C17H14N2O5S MolecularWeight: 358.36846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1C2=CC3=C(C(=C(C(=O)N3)C(=O)CCC(=O)O)CO)N=C2

Isomeric SMILES

C1=CSC=C1C2=CC3=C(C(=C(C(=O)N3)C(=O)CCC(=O)O)CO)N=C2

InChI

InChI=1S/C17H14N2O5S/c20-7-11-15(13(21)1-2-14(22)23)17(24)19-12-5-10(6-18-16(11)12)9-3-4-25-8-9/h3-6,8,20H,1-2,7H2,(H,19,24)(H,22,23)