(2,5-dimethylphenyl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: (2,5-dimethylphenyl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: (2,5-dimethylphenyl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetamidophenyl)sulfonylamino]propanoic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetamidophenyl)sulfonylamino]propionic acid (2,5-dimethylbenzyl) ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C20H24N2O5S/c1-14-4-5-15(2)17(12-14)13-27-20(24)10-11-21-28(25,26)19-8-6-18(7-9-19)22-16(3)23/h4-9,12,21H,10-11,13H2,1-3H3,(H,22,23)