2-[2-bromanylethanoyl(ethyl)amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-bromanylethanoyl(ethyl)amino]-3-phenyl-propanoic acid Openeye Name: 2-[(2-bromoacetyl)-ethyl-amino]-3-phenyl-propanoic acid CAS Name: 2-[(2-bromo-1-oxoethyl)-ethylamino]-3-phenylpropanoic acid IUPAC Name: 2-[(2-bromoacetyl)-ethylamino]-3-phenylpropanoic acid Traditional Name: 2-[(2-bromoacetyl)-ethyl-amino]-3-phenyl-propionic acid Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(CC1=CC=CC=C1)C(=O)O)C(=O)CBr

Isomeric SMILES

CCN(C(CC1=CC=CC=C1)C(=O)O)C(=O)CBr

InChI

InChI=1S/C13H16BrNO3/c1-2-15(12(16)9-14)11(13(17)18)8-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3,(H,17,18)