(3-morpholin-4-ylsulfonylphenyl)methyl 4-phenoxybutanoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-phenoxybutanoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 4-phenoxybutanoate CAS Name: 4-phenoxybutanoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-phenoxybutanoate Traditional Name: 4-phenoxybutyric acid (3-morpholinosulfonylbenzyl) ester Formula: C21H25NO6S MolecularWeight: 419.4913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)CCCOC3=CC=CC=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)CCCOC3=CC=CC=C3

InChI

InChI=1S/C21H25NO6S/c23-21(10-5-13-27-19-7-2-1-3-8-19)28-17-18-6-4-9-20(16-18)29(24,25)22-11-14-26-15-12-22/h1-4,6-9,16H,5,10-15,17H2