(4-acetamidophenyl) 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (4-acetamidophenyl) 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (4-acetamidophenyl) 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid (4-acetamidophenyl) ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C20H22N2O6S/c1-14-3-8-18(29(25,26)22-9-11-27-12-10-22)13-19(14)20(24)28-17-6-4-16(5-7-17)21-15(2)23/h3-8,13H,9-12H2,1-2H3,(H,21,23)