[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 4-butoxy-3-chloranyl-5-ethoxy-benzoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 4-butoxy-3-chloranyl-5-ethoxy-benzoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 4-butoxy-3-chloro-5-ethoxy-benzoate CAS Name: 4-butoxy-3-chloro-5-ethoxybenzoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 4-butoxy-3-chloro-5-ethoxybenzoate Traditional Name: 4-butoxy-3-chloro-5-ethoxy-benzoic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C19H27ClN2O6 MolecularWeight: 414.88048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27ClN2O6/c1-5-7-8-27-16-13(20)9-12(10-14(16)26-6-2)18(24)28-15(11(3)4)17(23)22-19(21)25/h9-11,15H,5-8H2,1-4H3,(H3,21,22,23,25)/t15-/m1/s1