5-[(3-chloranyl-2-fluoranyl-phenyl)amino]pentanoate

Systemtic Name: 5-[(3-chloranyl-2-fluoranyl-phenyl)amino]pentanoate Openeye Name: 5-(3-chloro-2-fluoro-anilino)pentanoate CAS Name: 5-(3-chloro-2-fluoroanilino)pentanoate IUPAC Name: 5-(3-chloro-2-fluoroanilino)pentanoate Traditional Name: 5-(3-chloro-2-fluoro-anilino)valerate Formula: C11H12ClFNO2- MolecularWeight: 244.669883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)F)NCCCCC(=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)F)NCCCCC(=O)[O-]

InChI

InChI=1S/C11H13ClFNO2/c12-8-4-3-5-9(11(8)13)14-7-2-1-6-10(15)16/h3-5,14H,1-2,6-7H2,(H,15,16)/p-1