(4-cyano-2-ethoxy-phenyl) 3-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (4-cyano-2-ethoxy-phenyl) 3-morpholin-4-ylsulfonylbenzoate Openeye Name: (4-cyano-2-ethoxy-phenyl) 3-morpholinosulfonylbenzoate CAS Name: 3-(4-morpholinylsulfonyl)benzoic acid (4-cyano-2-ethoxyphenyl) ester IUPAC Name: (4-cyano-2-ethoxyphenyl) 3-morpholin-4-ylsulfonylbenzoate Traditional Name: 3-morpholinosulfonylbenzoic acid (4-cyano-2-ethoxy-phenyl) ester Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H20N2O6S/c1-2-27-19-12-15(14-21)6-7-18(19)28-20(23)16-4-3-5-17(13-16)29(24,25)22-8-10-26-11-9-22/h3-7,12-13H,2,8-11H2,1H3