[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-butoxy-3-chloranyl-5-ethoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-butoxy-3-chloranyl-5-ethoxy-benzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 4-butoxy-3-chloro-5-ethoxy-benzoate CAS Name: 4-butoxy-3-chloro-5-ethoxybenzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 4-butoxy-3-chloro-5-ethoxybenzoate Traditional Name: 4-butoxy-3-chloro-5-ethoxy-benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H27ClN2O6 MolecularWeight: 414.88048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC(=O)NC(C)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC(=O)NC(C)C)OCC

InChI

InChI=1S/C19H27ClN2O6/c1-5-7-8-27-17-14(20)9-13(10-15(17)26-6-2)18(24)28-11-16(23)22-19(25)21-12(3)4/h9-10,12H,5-8,11H2,1-4H3,(H2,21,22,23,25)