[1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 4-butoxy-3-ethoxy-benzoate

Systemtic Name: [1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 4-butoxy-3-ethoxy-benzoate Openeye Name: [2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 4-butoxy-3-ethoxy-benzoate CAS Name: 4-butoxy-3-ethoxybenzoic acid [1-oxo-1-[[oxo-(propan-2-ylamino)methyl]amino]propan-2-yl] ester IUPAC Name: [1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 4-butoxy-3-ethoxybenzoate Traditional Name: 4-butoxy-3-ethoxy-benzoic acid [2-(isopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H30N2O6 MolecularWeight: 394.462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NC(=O)NC(C)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NC(=O)NC(C)C)OCC

InChI

InChI=1S/C20H30N2O6/c1-6-8-11-27-16-10-9-15(12-17(16)26-7-2)19(24)28-14(5)18(23)22-20(25)21-13(3)4/h9-10,12-14H,6-8,11H2,1-5H3,(H2,21,22,23,25)