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

Systemtic Name: 2-[4-[(4-aminocarbonyl-2-fluoranyl-phenyl)methyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[(4-carbamoyl-2-fluoro-phenyl)methyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[(4-carbamoyl-2-fluorophenyl)methyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[(4-carbamoyl-2-fluorophenyl)methyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-(4-carbamoyl-2-fluoro-benzyl)piperazino]acetic acid Formula: C14H18FN3O3 MolecularWeight: 295.309423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18FN3O3/c15-12-7-10(14(16)21)1-2-11(12)8-17-3-5-18(6-4-17)9-13(19)20/h1-2,7H,3-6,8-9H2,(H2,16,21)(H,19,20)