(phenylmethyl) 3-bromanyl-2-(3-phenylpropanoylamino)propanoate

Systemtic Name: (phenylmethyl) 3-bromanyl-2-(3-phenylpropanoylamino)propanoate Openeye Name: benzyl 3-bromo-2-(3-phenylpropanoylamino)propanoate CAS Name: 3-bromo-2-[(1-oxo-3-phenylpropyl)amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-bromo-2-(3-phenylpropanoylamino)propanoate Traditional Name: 3-bromo-2-(hydrocinnamoylamino)propionic acid benzyl ester Formula: C19H20BrNO3 MolecularWeight: 390.271

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC(CBr)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC(CBr)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H20BrNO3/c20-13-17(19(23)24-14-16-9-5-2-6-10-16)21-18(22)12-11-15-7-3-1-4-8-15/h1-10,17H,11-14H2,(H,21,22)