5-bromanyl-2-[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]oxy-benzoate

Systemtic Name: 5-bromanyl-2-[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]oxy-benzoate Openeye Name: 5-bromo-2-[(1S)-2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethoxy]benzoate CAS Name: 5-bromo-2-[(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]oxybenzoate IUPAC Name: 5-bromo-2-[(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]oxybenzoate Traditional Name: 5-bromo-2-[(1S)-2-(ethylcarbamoylamino)-2-keto-1-methyl-ethoxy]benzoate Formula: C13H14BrN2O5- MolecularWeight: 358.16466

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)OC1=C(C=C(C=C1)Br)C(=O)[O-]

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)OC1=C(C=C(C=C1)Br)C(=O)[O-]

InChI

InChI=1S/C13H15BrN2O5/c1-3-15-13(20)16-11(17)7(2)21-10-5-4-8(14)6-9(10)12(18)19/h4-7H,3H2,1-2H3,(H,18,19)(H2,15,16,17,20)/p-1/t7-/m0/s1