methyl 2-[(4-cyano-2-fluoranyl-phenyl)methylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[(4-cyano-2-fluoranyl-phenyl)methylamino]-3-methyl-butanoate Openeye Name: methyl 2-[(4-cyano-2-fluoro-phenyl)methylamino]-3-methyl-butanoate CAS Name: 2-[(4-cyano-2-fluorophenyl)methylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(4-cyano-2-fluorophenyl)methylamino]-3-methylbutanoate Traditional Name: 2-[(4-cyano-2-fluoro-benzyl)amino]-3-methyl-butyric acid methyl ester Formula: C14H17FN2O2 MolecularWeight: 264.295383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NCC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

CC(C)C(C(=O)OC)NCC1=C(C=C(C=C1)C#N)F

InChI

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