[4-(4-cyanophenyl)phenyl] 4-methoxy-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 4-methoxy-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 4-methoxy-3-morpholinosulfonyl-benzoate CAS Name: 4-methoxy-3-(4-morpholinylsulfonyl)benzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 4-methoxy-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-morpholinosulfonyl-benzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C25H22N2O6S MolecularWeight: 478.51698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H22N2O6S/c1-31-23-11-8-21(16-24(23)34(29,30)27-12-14-32-15-13-27)25(28)33-22-9-6-20(7-10-22)19-4-2-18(17-26)3-5-19/h2-11,16H,12-15H2,1H3