(4-cyanophenyl)methyl 2-[4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenoxy]ethanoate

Systemtic Name: (4-cyanophenyl)methyl 2-[4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenoxy]ethanoate Openeye Name: (4-cyanophenyl)methyl 2-[4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenoxy]acetate CAS Name: 2-[4-[(4-fluorophenyl)sulfonyl-methylamino]phenoxy]acetic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-[4-[(4-fluorophenyl)sulfonyl-methylamino]phenoxy]acetate Traditional Name: 2-[4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenoxy]acetic acid (4-cyanobenzyl) ester Formula: C23H19FN2O5S MolecularWeight: 454.470763

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OCC(=O)OCC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(C1=CC=C(C=C1)OCC(=O)OCC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H19FN2O5S/c1-26(32(28,29)22-12-6-19(24)7-13-22)20-8-10-21(11-9-20)30-16-23(27)31-15-18-4-2-17(14-25)3-5-18/h2-13H,15-16H2,1H3