methyl 2-[[(S)-(2-chloranyl-6-fluoranyl-phenyl)-cyano-methyl]amino]ethanoate

Systemtic Name: methyl 2-[[(S)-(2-chloranyl-6-fluoranyl-phenyl)-cyano-methyl]amino]ethanoate Openeye Name: methyl 2-[[(S)-(2-chloro-6-fluoro-phenyl)-cyano-methyl]amino]acetate CAS Name: 2-[[(S)-(2-chloro-6-fluorophenyl)-cyanomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(S)-(2-chloro-6-fluorophenyl)-cyanomethyl]amino]acetate Traditional Name: 2-[[(S)-(2-chloro-6-fluoro-phenyl)-cyano-methyl]amino]acetic acid methyl ester Formula: C11H10ClFN2O2 MolecularWeight: 256.660703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(C#N)C1=C(C=CC=C1Cl)F

Isomeric SMILES

COC(=O)CN[C@H](C#N)C1=C(C=CC=C1Cl)F

InChI

InChI=1S/C11H10ClFN2O2/c1-17-10(16)6-15-9(5-14)11-7(12)3-2-4-8(11)13/h2-4,9,15H,6H2,1H3/t9-/m1/s1