3-[3,5-bis(methoxycarbonyl)-4-oxidanylidene-pyridin-1-yl]benzoic acid

Systemtic Name: 3-[3,5-bis(methoxycarbonyl)-4-oxidanylidene-pyridin-1-yl]benzoic acid Openeye Name: 3-[3,5-bis(methoxycarbonyl)-4-oxo-1-pyridyl]benzoic acid CAS Name: 3-[3,5-bis(methoxycarbonyl)-4-oxo-1-pyridinyl]benzoic acid IUPAC Name: 3-[3,5-bis(methoxycarbonyl)-4-oxopyridin-1-yl]benzoic acid Traditional Name: 3-(3,5-dicarbomethoxy-4-keto-1-pyridyl)benzoic acid Formula: C16H13NO7 MolecularWeight: 331.27692

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C=C(C1=O)C(=O)OC)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

COC(=O)C1=CN(C=C(C1=O)C(=O)OC)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C16H13NO7/c1-23-15(21)11-7-17(8-12(13(11)18)16(22)24-2)10-5-3-4-9(6-10)14(19)20/h3-8H,1-2H3,(H,19,20)