[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 2-[(3-bromophenyl)methoxy]benzoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 2-[(3-bromophenyl)methoxy]benzoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 2-[(3-bromophenyl)methoxy]benzoate CAS Name: 2-[(3-bromophenyl)methoxy]benzoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 2-[(3-bromophenyl)methoxy]benzoate Traditional Name: 2-(3-bromobenzyl)oxybenzoic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C1=CC=CC=C1OCC2=CC(=CC=C2)Br

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)C1=CC=CC=C1OCC2=CC(=CC=C2)Br

InChI

InChI=1S/C19H20BrNO4/c1-3-21-18(22)13(2)25-19(23)16-9-4-5-10-17(16)24-12-14-7-6-8-15(20)11-14/h4-11,13H,3,12H2,1-2H3,(H,21,22)/t13-/m0/s1