dimethyl 2-(4-cyanophenyl)-4-methyl-6-morpholin-4-yl-benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 2-(4-cyanophenyl)-4-methyl-6-morpholin-4-yl-benzene-1,3-dicarboxylate Openeye Name: dimethyl 2-(4-cyanophenyl)-4-methyl-6-morpholino-benzene-1,3-dicarboxylate CAS Name: 2-(4-cyanophenyl)-4-methyl-6-(4-morpholinyl)benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(4-cyanophenyl)-4-methyl-6-morpholin-4-ylbenzene-1,3-dicarboxylate Traditional Name: 2-(4-cyanophenyl)-4-methyl-6-morpholino-benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)OC)C2=CC=C(C=C2)C#N)C(=O)OC)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)OC)C2=CC=C(C=C2)C#N)C(=O)OC)N3CCOCC3

InChI

InChI=1S/C22H22N2O5/c1-14-12-17(24-8-10-29-11-9-24)20(22(26)28-3)19(18(14)21(25)27-2)16-6-4-15(13-23)5-7-16/h4-7,12H,8-11H2,1-3H3