3-[(3-chloranyl-4-fluoranyl-phenyl)-ethyl-amino]propanoic acid

Systemtic Name: 3-[(3-chloranyl-4-fluoranyl-phenyl)-ethyl-amino]propanoic acid Openeye Name: 3-(3-chloro-N-ethyl-4-fluoro-anilino)propanoic acid CAS Name: 3-(3-chloro-N-ethyl-4-fluoroanilino)propanoic acid IUPAC Name: 3-(3-chloro-N-ethyl-4-fluoroanilino)propanoic acid Traditional Name: 3-(3-chloro-N-ethyl-4-fluoro-anilino)propionic acid Formula: C11H13ClFNO2 MolecularWeight: 245.677823

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(=O)O)C1=CC(=C(C=C1)F)Cl

Isomeric SMILES

CCN(CCC(=O)O)C1=CC(=C(C=C1)F)Cl

InChI

InChI=1S/C11H13ClFNO2/c1-2-14(6-5-11(15)16)8-3-4-10(13)9(12)7-8/h3-4,7H,2,5-6H2,1H3,(H,15,16)