(4-cyanophenyl)methyl 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

Systemtic Name: (4-cyanophenyl)methyl 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Openeye Name: (4-cyanophenyl)methyl 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate CAS Name: 3-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 3-(2,6-dimethylmorpholino)sulfonylbenzoic acid (4-cyanobenzyl) ester Formula: C21H22N2O5S MolecularWeight: 414.47478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H22N2O5S/c1-15-12-23(13-16(2)28-15)29(25,26)20-5-3-4-19(10-20)21(24)27-14-18-8-6-17(11-22)7-9-18/h3-10,15-16H,12-14H2,1-2H3