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

Systemtic Name: (4-cyanophenyl)methyl 4-[(3-fluoranyl-2-methyl-phenyl)sulfonylamino]benzoate Openeye Name: (4-cyanophenyl)methyl 4-[(3-fluoro-2-methyl-phenyl)sulfonylamino]benzoate CAS Name: 4-[(3-fluoro-2-methylphenyl)sulfonylamino]benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 4-[(3-fluoro-2-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[(3-fluoro-2-methyl-phenyl)sulfonylamino]benzoic acid (4-cyanobenzyl) ester Formula: C22H17FN2O4S MolecularWeight: 424.444783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)C#N)F

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)C#N)F

InChI

InChI=1S/C22H17FN2O4S/c1-15-20(23)3-2-4-21(15)30(27,28)25-19-11-9-18(10-12-19)22(26)29-14-17-7-5-16(13-24)6-8-17/h2-12,25H,14H2,1H3