(3-ethanoylphenyl) 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (3-ethanoylphenyl) 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (3-acetylphenyl) 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid (3-acetylphenyl) ester IUPAC Name: (3-acetylphenyl) 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid (3-acetylphenyl) ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO6S/c1-14-6-7-18(28(24,25)21-8-10-26-11-9-21)13-19(14)20(23)27-17-5-3-4-16(12-17)15(2)22/h3-7,12-13H,8-11H2,1-2H3