butyl 4-(4-morpholin-4-ylphenyl)sulfonylbenzoate

Systemtic Name: butyl 4-(4-morpholin-4-ylphenyl)sulfonylbenzoate Openeye Name: butyl 4-(4-morpholinophenyl)sulfonylbenzoate CAS Name: 4-[4-(4-morpholinyl)phenyl]sulfonylbenzoic acid butyl ester IUPAC Name: butyl 4-(4-morpholin-4-ylphenyl)sulfonylbenzoate Traditional Name: 4-(4-morpholinophenyl)sulfonylbenzoic acid butyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C21H25NO5S/c1-2-3-14-27-21(23)17-4-8-19(9-5-17)28(24,25)20-10-6-18(7-11-20)22-12-15-26-16-13-22/h4-11H,2-3,12-16H2,1H3