(3-morpholin-4-ylsulfonylphenyl)methyl 4-(4-methoxyphenoxy)butanoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-(4-methoxyphenoxy)butanoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 4-(4-methoxyphenoxy)butanoate CAS Name: 4-(4-methoxyphenoxy)butanoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-(4-methoxyphenoxy)butanoate Traditional Name: 4-(4-methoxyphenoxy)butyric acid (3-morpholinosulfonylbenzyl) ester Formula: C22H27NO7S MolecularWeight: 449.51728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCCC(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)OCCCC(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H27NO7S/c1-27-19-7-9-20(10-8-19)29-13-3-6-22(24)30-17-18-4-2-5-21(16-18)31(25,26)23-11-14-28-15-12-23/h2,4-5,7-10,16H,3,6,11-15,17H2,1H3