2-[5-[[5-[2,4,6-tris(oxidanyl)phenyl]pyridin-3-yl]carbonylamino]thiophen-2-yl]ethanoic acid

Systemtic Name: 2-[5-[[5-[2,4,6-tris(oxidanyl)phenyl]pyridin-3-yl]carbonylamino]thiophen-2-yl]ethanoic acid Openeye Name: 2-[5-[[5-(2,4,6-trihydroxyphenyl)pyridine-3-carbonyl]amino]-2-thienyl]acetic acid CAS Name: 2-[5-[[oxo-[5-(2,4,6-trihydroxyphenyl)-3-pyridinyl]methyl]amino]-2-thiophenyl]acetic acid IUPAC Name: 2-[5-[[5-(2,4,6-trihydroxyphenyl)pyridine-3-carbonyl]amino]thiophen-2-yl]acetic acid Traditional Name: 2-[5-[[5-(2,4,6-trihydroxyphenyl)nicotinoyl]amino]-2-thienyl]acetic acid Formula: C18H14N2O6S MolecularWeight: 386.37856

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)NC(=O)C2=CN=CC(=C2)C3=C(C=C(C=C3O)O)O)CC(=O)O

Isomeric SMILES

C1=C(SC(=C1)NC(=O)C2=CN=CC(=C2)C3=C(C=C(C=C3O)O)O)CC(=O)O

InChI

InChI=1S/C18H14N2O6S/c21-11-4-13(22)17(14(23)5-11)9-3-10(8-19-7-9)18(26)20-15-2-1-12(27-15)6-16(24)25/h1-5,7-8,21-23H,6H2,(H,20,26)(H,24,25)