(4-propanoylphenyl) 4-methyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (4-propanoylphenyl) 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (4-propanoylphenyl) 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-morpholinosulfonyl-benzoic acid (4-propionylphenyl) ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H23NO6S/c1-3-19(23)16-6-8-18(9-7-16)28-21(24)17-5-4-15(2)20(14-17)29(25,26)22-10-12-27-13-11-22/h4-9,14H,3,10-13H2,1-2H3