(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 4-cyanobenzoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 4-cyanobenzoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C19H13NO5 MolecularWeight: 335.31022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H13NO5/c1-23-15-6-7-16-14(8-18(21)25-17(16)9-15)11-24-19(22)13-4-2-12(10-20)3-5-13/h2-9H,11H2,1H3