(3,4-dimethylphenyl) 3-(4-morpholin-4-ylsulfonylphenyl)propanoate

Systemtic Name: (3,4-dimethylphenyl) 3-(4-morpholin-4-ylsulfonylphenyl)propanoate Openeye Name: (3,4-dimethylphenyl) 3-(4-morpholinosulfonylphenyl)propanoate CAS Name: 3-[4-(4-morpholinylsulfonyl)phenyl]propanoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 3-(4-morpholin-4-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-morpholinosulfonylphenyl)propionic acid (3,4-dimethylphenyl) ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C21H25NO5S/c1-16-3-7-19(15-17(16)2)27-21(23)10-6-18-4-8-20(9-5-18)28(24,25)22-11-13-26-14-12-22/h3-5,7-9,15H,6,10-14H2,1-2H3