[1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate

Systemtic Name: [1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate Openeye Name: [2-(3,4-dimethylphenyl)-1-methyl-2-oxo-ethyl] 2-[(3,4-dimethylphenyl)sulfonylamino]acetate CAS Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid [1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] 2-[(3,4-dimethylphenyl)sulfonylamino]acetate Traditional Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid [2-(3,4-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)OC(=O)CNS(=O)(=O)C2=CC(=C(C=C2)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(C)OC(=O)CNS(=O)(=O)C2=CC(=C(C=C2)C)C)C

InChI

InChI=1S/C21H25NO5S/c1-13-6-8-18(10-15(13)3)21(24)17(5)27-20(23)12-22-28(25,26)19-9-7-14(2)16(4)11-19/h6-11,17,22H,12H2,1-5H3