2-[3-[(4-cyano-3-fluoranyl-phenyl)methyl]imidazol-4-yl]ethyl-pyrrolidin-3-yl-carbamic acid

Systemtic Name: 2-[3-[(4-cyano-3-fluoranyl-phenyl)methyl]imidazol-4-yl]ethyl-pyrrolidin-3-yl-carbamic acid Openeye Name: 2-[3-[(4-cyano-3-fluoro-phenyl)methyl]imidazol-4-yl]ethyl-pyrrolidin-3-yl-carbamic acid CAS Name: 2-[3-[(4-cyano-3-fluorophenyl)methyl]-4-imidazolyl]ethyl-(3-pyrrolidinyl)carbamic acid IUPAC Name: 2-[3-[(4-cyano-3-fluorophenyl)methyl]imidazol-4-yl]ethyl-pyrrolidin-3-ylcarbamic acid Traditional Name: 2-[3-(4-cyano-3-fluoro-benzyl)imidazol-4-yl]ethyl-pyrrolidin-3-yl-carbamic acid Formula: C18H20FN5O2 MolecularWeight: 357.382103

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1N(CCC2=CN=CN2CC3=CC(=C(C=C3)C#N)F)C(=O)O

Isomeric SMILES

C1CNCC1N(CCC2=CN=CN2CC3=CC(=C(C=C3)C#N)F)C(=O)O

InChI

InChI=1S/C18H20FN5O2/c19-17-7-13(1-2-14(17)8-20)11-23-12-22-9-15(23)4-6-24(18(25)26)16-3-5-21-10-16/h1-2,7,9,12,16,21H,3-6,10-11H2,(H,25,26)