[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 2-(3-bromanylphenoxy)ethanoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 2-(3-bromanylphenoxy)ethanoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 2-(3-bromophenoxy)acetate CAS Name: 2-(3-bromophenoxy)acetic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 2-(3-bromophenoxy)acetate Traditional Name: 2-(3-bromophenoxy)acetic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C13H16BrNO4 MolecularWeight: 330.17444

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)COC1=CC(=CC=C1)Br

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)COC1=CC(=CC=C1)Br

InChI

InChI=1S/C13H16BrNO4/c1-3-15-13(17)9(2)19-12(16)8-18-11-6-4-5-10(14)7-11/h4-7,9H,3,8H2,1-2H3,(H,15,17)/t9-/m0/s1