[2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate Openeye Name: [2-(4-ethylphenyl)-2-oxo-ethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoic acid [2-(4-ethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylphenyl)-2-oxoethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-(mesitylsulfonylamino)propionic acid [2-(4-ethylphenyl)-2-keto-ethyl] ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)COC(=O)CCNS(=O)(=O)C2=C(C=C(C=C2C)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)COC(=O)CCNS(=O)(=O)C2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C22H27NO5S/c1-5-18-6-8-19(9-7-18)20(24)14-28-21(25)10-11-23-29(26,27)22-16(3)12-15(2)13-17(22)4/h6-9,12-13,23H,5,10-11,14H2,1-4H3