2-[3-ethoxycarbonyl-7-(1-hydroxyethyl)-5-oxidanylidene-chromeno[2,3-b]pyridin-2-yl]butanoic acid

Systemtic Name: 2-[3-ethoxycarbonyl-7-(1-hydroxyethyl)-5-oxidanylidene-chromeno[2,3-b]pyridin-2-yl]butanoic acid Openeye Name: 2-[3-ethoxycarbonyl-7-(1-hydroxyethyl)-5-oxo-chromeno[2,3-b]pyridin-2-yl]butanoic acid CAS Name: 2-[3-ethoxycarbonyl-7-(1-hydroxyethyl)-5-oxo-2-[1]benzopyrano[2,3-b]pyridinyl]butanoic acid IUPAC Name: 2-[3-ethoxycarbonyl-7-(1-hydroxyethyl)-5-oxochromeno[2,3-b]pyridin-2-yl]butanoic acid Traditional Name: 2-[3-carbethoxy-7-(1-hydroxyethyl)-5-keto-chromeno[2,3-b]pyridin-2-yl]butyric acid Formula: C21H21NO7 MolecularWeight: 399.39394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=C2C(=O)C3=C(C=CC(=C3)C(C)O)OC2=N1)C(=O)OCC)C(=O)O

Isomeric SMILES

CCC(C1=C(C=C2C(=O)C3=C(C=CC(=C3)C(C)O)OC2=N1)C(=O)OCC)C(=O)O

InChI

InChI=1S/C21H21NO7/c1-4-12(20(25)26)17-14(21(27)28-5-2)9-15-18(24)13-8-11(10(3)23)6-7-16(13)29-19(15)22-17/h6-10,12,23H,4-5H2,1-3H3,(H,25,26)