[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 3-ethoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 3-ethoxy-4-(2-methylpropoxy)benzoate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 3-ethoxy-4-isobutoxy-benzoate CAS Name: 3-ethoxy-4-(2-methylpropoxy)benzoic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 3-ethoxy-4-(2-methylpropoxy)benzoate Traditional Name: 3-ethoxy-4-isobutoxy-benzoic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H30N2O6 MolecularWeight: 394.462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)C1=CC(=C(C=C1)OCC(C)C)OCC

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)C1=CC(=C(C=C1)OCC(C)C)OCC

InChI

InChI=1S/C20H30N2O6/c1-5-7-10-21-20(25)22-18(23)13-28-19(24)15-8-9-16(27-12-14(3)4)17(11-15)26-6-2/h8-9,11,14H,5-7,10,12-13H2,1-4H3,(H2,21,22,23,25)