[(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 4-butoxy-3-chloranyl-5-ethoxy-benzoate

Systemtic Name: [(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 4-butoxy-3-chloranyl-5-ethoxy-benzoate Openeye Name: [(1R)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl] 4-butoxy-3-chloro-5-ethoxy-benzoate CAS Name: 4-butoxy-3-chloro-5-ethoxybenzoic acid [(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] 4-butoxy-3-chloro-5-ethoxybenzoate Traditional Name: 4-butoxy-3-chloro-5-ethoxy-benzoic acid [(1R)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl] ester Formula: C18H25ClN2O6 MolecularWeight: 400.8539

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)O[C@H](C)C(=O)NC(=O)NC)OCC

InChI

InChI=1S/C18H25ClN2O6/c1-5-7-8-26-15-13(19)9-12(10-14(15)25-6-2)17(23)27-11(3)16(22)21-18(24)20-4/h9-11H,5-8H2,1-4H3,(H2,20,21,22,24)/t11-/m1/s1