2-[4-[(5-cyano-2-fluoranyl-phenyl)methyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(5-cyano-2-fluoranyl-phenyl)methyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[(5-cyano-2-fluoro-phenyl)methyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[(5-cyano-2-fluorophenyl)methyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[(5-cyano-2-fluorophenyl)methyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-(5-cyano-2-fluoro-benzyl)piperazino]acetic acid Formula: C14H16FN3O2 MolecularWeight: 277.294143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC(=C2)C#N)F)CC(=O)O

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC(=C2)C#N)F)CC(=O)O

InChI

InChI=1S/C14H16FN3O2/c15-13-2-1-11(8-16)7-12(13)9-17-3-5-18(6-4-17)10-14(19)20/h1-2,7H,3-6,9-10H2,(H,19,20)