[1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 2-[(4-methylphenyl)sulfonylamino]ethanoate

Systemtic Name: [1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 2-[(4-methylphenyl)sulfonylamino]ethanoate Openeye Name: [1-methyl-2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 2-(p-tolylsulfonylamino)acetate CAS Name: 2-[(4-methylphenyl)sulfonylamino]acetic acid [1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] 2-[(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-(tosylamino)acetic acid [2-keto-1-methyl-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OC(C)C(=O)C2=CC(=C(C=C2C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OC(C)C(=O)C2=CC(=C(C=C2C)C)C

InChI

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