2-(3-ethoxycarbonyl-1-methyl-6-oxidanyl-4-oxidanylidene-7H-pyrrolo[2,3-b]pyridin-5-yl)ethanoic acid

Systemtic Name: 2-(3-ethoxycarbonyl-1-methyl-6-oxidanyl-4-oxidanylidene-7H-pyrrolo[2,3-b]pyridin-5-yl)ethanoic acid Openeye Name: 2-(3-ethoxycarbonyl-6-hydroxy-1-methyl-4-oxo-7H-pyrrolo[2,3-b]pyridin-5-yl)acetic acid CAS Name: 2-(3-ethoxycarbonyl-6-hydroxy-1-methyl-4-oxo-7H-pyrrolo[2,3-b]pyridin-5-yl)acetic acid IUPAC Name: 2-(3-ethoxycarbonyl-6-hydroxy-1-methyl-4-oxo-7H-pyrrolo[2,3-b]pyridin-5-yl)acetic acid Traditional Name: 2-(3-carbethoxy-6-hydroxy-4-keto-1-methyl-7H-pyrrolo[2,3-b]pyridin-5-yl)acetic acid Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C1C(=O)C(=C(N2)O)CC(=O)O)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C1C(=O)C(=C(N2)O)CC(=O)O)C

InChI

InChI=1S/C13H14N2O6/c1-3-21-13(20)7-5-15(2)11-9(7)10(18)6(4-8(16)17)12(19)14-11/h5H,3-4H2,1-2H3,(H,16,17)(H2,14,18,19)