(2-cyanophenyl)methyl 2-methoxy-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (2-cyanophenyl)methyl 2-methoxy-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2-cyanophenyl)methyl 2-methoxy-5-morpholinosulfonyl-benzoate CAS Name: 2-methoxy-5-(4-morpholinylsulfonyl)benzoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-methoxy-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methoxy-5-morpholinosulfonyl-benzoic acid (2-cyanobenzyl) ester Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC3=CC=CC=C3C#N

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H20N2O6S/c1-26-19-7-6-17(29(24,25)22-8-10-27-11-9-22)12-18(19)20(23)28-14-16-5-3-2-4-15(16)13-21/h2-7,12H,8-11,14H2,1H3