[(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 3-bromanyl-4-ethoxy-5-methoxy-benzoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 3-bromanyl-4-ethoxy-5-methoxy-benzoate Openeye Name: [(1R)-1-methyl-2-oxo-2-ureido-ethyl] 3-bromo-4-ethoxy-5-methoxy-benzoate CAS Name: 3-bromo-4-ethoxy-5-methoxybenzoic acid [(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] 3-bromo-4-ethoxy-5-methoxybenzoate Traditional Name: 3-bromo-4-ethoxy-5-methoxy-benzoic acid [(1R)-2-keto-1-methyl-2-ureido-ethyl] ester Formula: C14H17BrN2O6 MolecularWeight: 389.19858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)OC(C)C(=O)NC(=O)N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)O[C@H](C)C(=O)NC(=O)N)OC

InChI

InChI=1S/C14H17BrN2O6/c1-4-22-11-9(15)5-8(6-10(11)21-3)13(19)23-7(2)12(18)17-14(16)20/h5-7H,4H2,1-3H3,(H3,16,17,18,20)/t7-/m1/s1