[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 2-bromanylbenzoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 2-bromanylbenzoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C12H14BrNO3 MolecularWeight: 300.14846

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C1=CC=CC=C1Br

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C12H14BrNO3/c1-3-14-11(15)8(2)17-12(16)9-6-4-5-7-10(9)13/h4-8H,3H2,1-2H3,(H,14,15)/t8-/m0/s1