(3-cyanophenyl)methyl 3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: (3-cyanophenyl)methyl 3-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoate Openeye Name: (3-cyanophenyl)methyl 3-methoxy-4-(2-morpholino-2-oxo-ethoxy)benzoate CAS Name: 3-methoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]benzoic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 3-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoate Traditional Name: 4-(2-keto-2-morpholino-ethoxy)-3-methoxy-benzoic acid (3-cyanobenzyl) ester Formula: C22H22N2O6 MolecularWeight: 410.41988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC2=CC=CC(=C2)C#N)OCC(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC2=CC=CC(=C2)C#N)OCC(=O)N3CCOCC3

InChI

InChI=1S/C22H22N2O6/c1-27-20-12-18(22(26)30-14-17-4-2-3-16(11-17)13-23)5-6-19(20)29-15-21(25)24-7-9-28-10-8-24/h2-6,11-12H,7-10,14-15H2,1H3