4-[7-(cyanomethoxy)-4-oxidanylidene-chromen-3-yl]oxy-2-ethyl-benzoic acid

Systemtic Name: 4-[7-(cyanomethoxy)-4-oxidanylidene-chromen-3-yl]oxy-2-ethyl-benzoic acid Openeye Name: 4-[7-(cyanomethoxy)-4-oxo-chromen-3-yl]oxy-2-ethyl-benzoic acid CAS Name: 4-[[7-(cyanomethoxy)-4-oxo-1-benzopyran-3-yl]oxy]-2-ethylbenzoic acid IUPAC Name: 4-[7-(cyanomethoxy)-4-oxochromen-3-yl]oxy-2-ethylbenzoic acid Traditional Name: 4-[7-(cyanomethoxy)-4-keto-chromen-3-yl]oxy-2-ethyl-benzoic acid Formula: C20H15NO6 MolecularWeight: 365.3362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC#N)C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC#N)C(=O)O

InChI

InChI=1S/C20H15NO6/c1-2-12-9-14(4-5-15(12)20(23)24)27-18-11-26-17-10-13(25-8-7-21)3-6-16(17)19(18)22/h3-6,9-11H,2,8H2,1H3,(H,23,24)