[(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-5-bromanyl-benzoate

Systemtic Name: [(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-5-bromanyl-benzoate Openeye Name: [(1R)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethyl] 2-amino-5-bromo-benzoate CAS Name: 2-amino-5-bromobenzoic acid [(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] 2-amino-5-bromobenzoate Traditional Name: 2-amino-5-bromo-benzoic acid [(1R)-2-keto-2-(2-methoxyethylamino)-1-methyl-ethyl] ester Formula: C13H17BrN2O4 MolecularWeight: 345.18908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCOC)OC(=O)C1=C(C=CC(=C1)Br)N

Isomeric SMILES

C[C@H](C(=O)NCCOC)OC(=O)C1=C(C=CC(=C1)Br)N

InChI

InChI=1S/C13H17BrN2O4/c1-8(12(17)16-5-6-19-2)20-13(18)10-7-9(14)3-4-11(10)15/h3-4,7-8H,5-6,15H2,1-2H3,(H,16,17)/t8-/m1/s1