2-[(4-cyano-2-fluoranyl-phenyl)methylamino]-2-methyl-pentanoic acid

Systemtic Name: 2-[(4-cyano-2-fluoranyl-phenyl)methylamino]-2-methyl-pentanoic acid Openeye Name: 2-[(4-cyano-2-fluoro-phenyl)methylamino]-2-methyl-pentanoic acid CAS Name: 2-[(4-cyano-2-fluorophenyl)methylamino]-2-methylpentanoic acid IUPAC Name: 2-[(4-cyano-2-fluorophenyl)methylamino]-2-methylpentanoic acid Traditional Name: 2-[(4-cyano-2-fluoro-benzyl)amino]-2-methyl-valeric acid Formula: C14H17FN2O2 MolecularWeight: 264.295383

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NCC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

CCCC(C)(C(=O)O)NCC1=C(C=C(C=C1)C#N)F

InChI

InChI=1S/C14H17FN2O2/c1-3-6-14(2,13(18)19)17-9-11-5-4-10(8-16)7-12(11)15/h4-5,7,17H,3,6,9H2,1-2H3,(H,18,19)