[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-chloranyl-5-ethoxy-4-propoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-chloranyl-5-ethoxy-4-propoxy-benzoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 3-chloro-5-ethoxy-4-propoxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-propoxybenzoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 3-chloro-5-ethoxy-4-propoxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-propoxy-benzoic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H23ClN2O6 MolecularWeight: 398.83802

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC(=O)NCC=C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC(=O)NCC=C)OCC

InChI

InChI=1S/C18H23ClN2O6/c1-4-7-20-18(24)21-15(22)11-27-17(23)12-9-13(19)16(26-8-5-2)14(10-12)25-6-3/h4,9-10H,1,5-8,11H2,2-3H3,(H2,20,21,22,24)