2-[(2-chloranyl-4-fluoranyl-phenyl)methylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[(2-chloranyl-4-fluoranyl-phenyl)methylamino]-3-methyl-butanoic acid Openeye Name: 2-[(2-chloro-4-fluoro-phenyl)methylamino]-3-methyl-butanoic acid CAS Name: 2-[(2-chloro-4-fluorophenyl)methylamino]-3-methylbutanoic acid IUPAC Name: 2-[(2-chloro-4-fluorophenyl)methylamino]-3-methylbutanoic acid Traditional Name: 2-[(2-chloro-4-fluoro-benzyl)amino]-3-methyl-butyric acid Formula: C12H15ClFNO2 MolecularWeight: 259.704403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC1=C(C=C(C=C1)F)Cl

Isomeric SMILES

CC(C)C(C(=O)O)NCC1=C(C=C(C=C1)F)Cl

InChI

InChI=1S/C12H15ClFNO2/c1-7(2)11(12(16)17)15-6-8-3-4-9(14)5-10(8)13/h3-5,7,11,15H,6H2,1-2H3,(H,16,17)