[2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 2-[(2-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: [2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] 2-[(2-cyanophenyl)sulfonylamino]ethanoate Openeye Name: [2-(2,5-diethylphenyl)-2-oxo-ethyl] 2-[(2-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid [2-(2,5-diethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-diethylphenyl)-2-oxoethyl] 2-[(2-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(2-cyanophenyl)sulfonylamino]acetic acid [2-(2,5-diethylphenyl)-2-keto-ethyl] ester Formula: C21H22N2O5S MolecularWeight: 414.47478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)CNS(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)CNS(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C21H22N2O5S/c1-3-15-9-10-16(4-2)18(11-15)19(24)14-28-21(25)13-23-29(26,27)20-8-6-5-7-17(20)12-22/h5-11,23H,3-4,13-14H2,1-2H3