2-azanyl-3-[4-(2-bromanylethanoylamino)phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-(2-bromanylethanoylamino)phenyl]propanoic acid Openeye Name: 2-amino-3-[4-[(2-bromoacetyl)amino]phenyl]propanoic acid CAS Name: 2-amino-3-[4-[(2-bromo-1-oxoethyl)amino]phenyl]propanoic acid IUPAC Name: 2-amino-3-[4-[(2-bromoacetyl)amino]phenyl]propanoic acid Traditional Name: 2-amino-3-[4-[(2-bromoacetyl)amino]phenyl]propionic acid Formula: C11H13BrN2O3 MolecularWeight: 301.13652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)N)NC(=O)CBr

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)N)NC(=O)CBr

InChI

InChI=1S/C11H13BrN2O3/c12-6-10(15)14-8-3-1-7(2-4-8)5-9(13)11(16)17/h1-4,9H,5-6,13H2,(H,14,15)(H,16,17)