(3-morpholin-4-ylsulfonylphenyl)methyl 5-ethanoylthiophene-2-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 5-ethanoylthiophene-2-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 5-acetylthiophene-2-carboxylate CAS Name: 5-acetyl-2-thiophenecarboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 5-acetylthiophene-2-carboxylate Traditional Name: 5-acetylthiophene-2-carboxylic acid (3-morpholinosulfonylbenzyl) ester Formula: C18H19NO6S2 MolecularWeight: 409.47656

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H19NO6S2/c1-13(20)16-5-6-17(26-16)18(21)25-12-14-3-2-4-15(11-14)27(22,23)19-7-9-24-10-8-19/h2-6,11H,7-10,12H2,1H3