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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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