3-[3-(3-bromophenyl)propanoylamino]propanoic acid

Systemtic Name: 3-[3-(3-bromophenyl)propanoylamino]propanoic acid Openeye Name: 3-[3-(3-bromophenyl)propanoylamino]propanoic acid CAS Name: 3-[[3-(3-bromophenyl)-1-oxopropyl]amino]propanoic acid IUPAC Name: 3-[3-(3-bromophenyl)propanoylamino]propanoic acid Traditional Name: 3-[3-(3-bromophenyl)propanoylamino]propionic acid Formula: C12H14BrNO3 MolecularWeight: 300.14846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CCC(=O)NCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)CCC(=O)NCCC(=O)O

InChI

InChI=1S/C12H14BrNO3/c13-10-3-1-2-9(8-10)4-5-11(15)14-7-6-12(16)17/h1-3,8H,4-7H2,(H,14,15)(H,16,17)