ethyl 4-[7-(cyanomethoxy)-2-methyl-4-oxidanylidene-chromen-3-yl]oxybenzoate

Systemtic Name: ethyl 4-[7-(cyanomethoxy)-2-methyl-4-oxidanylidene-chromen-3-yl]oxybenzoate Openeye Name: ethyl 4-[7-(cyanomethoxy)-2-methyl-4-oxo-chromen-3-yl]oxybenzoate CAS Name: 4-[[7-(cyanomethoxy)-2-methyl-4-oxo-1-benzopyran-3-yl]oxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[7-(cyanomethoxy)-2-methyl-4-oxochromen-3-yl]oxybenzoate Traditional Name: 4-[7-(cyanomethoxy)-4-keto-2-methyl-chromen-3-yl]oxybenzoic acid ethyl ester Formula: C21H17NO6 MolecularWeight: 379.36278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC#N)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC#N)C

InChI

InChI=1S/C21H17NO6/c1-3-25-21(24)14-4-6-15(7-5-14)28-20-13(2)27-18-12-16(26-11-10-22)8-9-17(18)19(20)23/h4-9,12H,3,11H2,1-2H3