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

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-chloranyl-4-ethoxy-5-methoxy-benzoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 3-chloro-4-ethoxy-5-methoxy-benzoate CAS Name: 3-chloro-4-ethoxy-5-methoxybenzoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-chloro-4-ethoxy-5-methoxybenzoate Traditional Name: 3-chloro-4-ethoxy-5-methoxy-benzoic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C16H21ClN2O6 MolecularWeight: 372.80074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)OC(C(C)C)C(=O)NC(=O)N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)O[C@H](C(C)C)C(=O)NC(=O)N)OC

InChI

InChI=1S/C16H21ClN2O6/c1-5-24-13-10(17)6-9(7-11(13)23-4)15(21)25-12(8(2)3)14(20)19-16(18)22/h6-8,12H,5H2,1-4H3,(H3,18,19,20,22)/t12-/m1/s1