[4-(4-cyanophenyl)phenyl] 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C25H22N2O5S MolecularWeight: 462.51758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H22N2O5S/c1-18-2-11-23(33(29,30)27-12-14-31-15-13-27)16-24(18)25(28)32-22-9-7-21(8-10-22)20-5-3-19(17-26)4-6-20/h2-11,16H,12-15H2,1H3