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

Systemtic Name: 2-(3-ethoxycarbonyl-7-nitro-5-oxidanylidene-chromeno[2,3-b]pyridin-2-yl)butanoic acid Openeye Name: 2-(3-ethoxycarbonyl-7-nitro-5-oxo-chromeno[2,3-b]pyridin-2-yl)butanoic acid CAS Name: 2-(3-ethoxycarbonyl-7-nitro-5-oxo-2-[1]benzopyrano[2,3-b]pyridinyl)butanoic acid IUPAC Name: 2-(3-ethoxycarbonyl-7-nitro-5-oxochromeno[2,3-b]pyridin-2-yl)butanoic acid Traditional Name: 2-(3-carbethoxy-5-keto-7-nitro-chromeno[2,3-b]pyridin-2-yl)butyric acid Formula: C19H16N2O8 MolecularWeight: 400.33894

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=C2C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC2=N1)C(=O)OCC)C(=O)O

Isomeric SMILES

CCC(C1=C(C=C2C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])OC2=N1)C(=O)OCC)C(=O)O

InChI

InChI=1S/C19H16N2O8/c1-3-10(18(23)24)15-12(19(25)28-4-2)8-13-16(22)11-7-9(21(26)27)5-6-14(11)29-17(13)20-15/h5-8,10H,3-4H2,1-2H3,(H,23,24)