4-(3-cyano-2-oxidanylidene-chromen-8-yl)oxybutanoic acid

Systemtic Name: 4-(3-cyano-2-oxidanylidene-chromen-8-yl)oxybutanoic acid Openeye Name: 4-(3-cyano-2-oxo-chromen-8-yl)oxybutanoic acid CAS Name: 4-[(3-cyano-2-oxo-1-benzopyran-8-yl)oxy]butanoic acid IUPAC Name: 4-(3-cyano-2-oxochromen-8-yl)oxybutanoic acid Traditional Name: 4-(3-cyano-2-keto-chromen-8-yl)oxybutyric acid Formula: C14H11NO5 MolecularWeight: 273.24084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)OCCCC(=O)O)OC(=O)C(=C2)C#N

Isomeric SMILES

C1=CC2=C(C(=C1)OCCCC(=O)O)OC(=O)C(=C2)C#N

InChI

InChI=1S/C14H11NO5/c15-8-10-7-9-3-1-4-11(13(9)20-14(10)18)19-6-2-5-12(16)17/h1,3-4,7H,2,5-6H2,(H,16,17)