[4-(2-cyanophenyl)phenyl]methyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl 4-fluoranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [4-(2-cyanophenyl)phenyl]methyl 4-fluoro-3-morpholinosulfonyl-benzoate CAS Name: 4-fluoro-3-(4-morpholinylsulfonyl)benzoic acid [4-(2-cyanophenyl)phenyl]methyl ester IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl 4-fluoro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-morpholinosulfonyl-benzoic acid [4-(2-cyanophenyl)benzyl] ester Formula: C25H21FN2O5S MolecularWeight: 480.508043

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=C(C=C3)C4=CC=CC=C4C#N)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=C(C=C3)C4=CC=CC=C4C#N)F

InChI

InChI=1S/C25H21FN2O5S/c26-23-10-9-20(15-24(23)34(30,31)28-11-13-32-14-12-28)25(29)33-17-18-5-7-19(8-6-18)22-4-2-1-3-21(22)16-27/h1-10,15H,11-14,17H2