(4-ethylphenyl) 4-ethyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (4-ethylphenyl) 4-ethyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (4-ethylphenyl) 4-ethyl-3-morpholinosulfonyl-benzoate CAS Name: 4-ethyl-3-(4-morpholinylsulfonyl)benzoic acid (4-ethylphenyl) ester IUPAC Name: (4-ethylphenyl) 4-ethyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-ethyl-3-morpholinosulfonyl-benzoic acid (4-ethylphenyl) ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)CC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)CC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H25NO5S/c1-3-16-5-9-19(10-6-16)27-21(23)18-8-7-17(4-2)20(15-18)28(24,25)22-11-13-26-14-12-22/h5-10,15H,3-4,11-14H2,1-2H3