3-azanyl-4-[(4-cyano-2-fluoranyl-phenyl)methoxy]benzoic acid

Systemtic Name: 3-azanyl-4-[(4-cyano-2-fluoranyl-phenyl)methoxy]benzoic acid Openeye Name: 3-amino-4-[(4-cyano-2-fluoro-phenyl)methoxy]benzoic acid CAS Name: 3-amino-4-[(4-cyano-2-fluorophenyl)methoxy]benzoic acid IUPAC Name: 3-amino-4-[(4-cyano-2-fluorophenyl)methoxy]benzoic acid Traditional Name: 3-amino-4-(4-cyano-2-fluoro-benzyl)oxy-benzoic acid Formula: C15H11FN2O3 MolecularWeight: 286.257843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)F)COC2=C(C=C(C=C2)C(=O)O)N

Isomeric SMILES

C1=CC(=C(C=C1C#N)F)COC2=C(C=C(C=C2)C(=O)O)N

InChI

InChI=1S/C15H11FN2O3/c16-12-5-9(7-17)1-2-11(12)8-21-14-4-3-10(15(19)20)6-13(14)18/h1-6H,8,18H2,(H,19,20)