[2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromanylphenoxy)propanoate

Systemtic Name: [2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromanylphenoxy)propanoate Openeye Name: [2-[N-(cyanomethyl)anilino]-2-oxo-ethyl] 2-(4-bromophenoxy)propanoate CAS Name: 2-(4-bromophenoxy)propanoic acid [2-[N-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(cyanomethyl)anilino]-2-oxoethyl] 2-(4-bromophenoxy)propanoate Traditional Name: 2-(4-bromophenoxy)propionic acid [2-[N-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C19H17BrN2O4 MolecularWeight: 417.25328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)N(CC#N)C1=CC=CC=C1)OC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C(=O)OCC(=O)N(CC#N)C1=CC=CC=C1)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C19H17BrN2O4/c1-14(26-17-9-7-15(20)8-10-17)19(24)25-13-18(23)22(12-11-21)16-5-3-2-4-6-16/h2-10,14H,12-13H2,1H3