ethyl 5-[3-(4-cyanophenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 5-[3-(4-cyanophenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 5-[3-(4-cyanophenoxy)-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylate CAS Name: 5-[3-(4-cyanophenoxy)-2-hydroxypropoxy]-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(4-cyanophenoxy)-2-hydroxypropoxy]-4-oxochromene-2-carboxylate Traditional Name: 5-[3-(4-cyanophenoxy)-2-hydroxy-propoxy]-4-keto-chromene-2-carboxylic acid ethyl ester Formula: C22H19NO7 MolecularWeight: 409.38876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OCC(COC3=CC=C(C=C3)C#N)O

Isomeric SMILES

CCOC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OCC(COC3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C22H19NO7/c1-2-27-22(26)20-10-17(25)21-18(4-3-5-19(21)30-20)29-13-15(24)12-28-16-8-6-14(11-23)7-9-16/h3-10,15,24H,2,12-13H2,1H3