1-[1-[(4-fluorophenyl)methyl]imidazol-4-yl]butane-1,3-dione

Systemtic Name: 1-[1-[(4-fluorophenyl)methyl]imidazol-4-yl]butane-1,3-dione Openeye Name: 1-[1-[(4-fluorophenyl)methyl]imidazol-4-yl]butane-1,3-dione CAS Name: 1-[1-[(4-fluorophenyl)methyl]-4-imidazolyl]butane-1,3-dione IUPAC Name: 1-[1-[(4-fluorophenyl)methyl]imidazol-4-yl]butane-1,3-dione Traditional Name: 1-[1-(4-fluorobenzyl)imidazol-4-yl]butane-1,3-dione Formula: C14H13FN2O2 MolecularWeight: 260.263623

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C1=CN(C=N1)CC2=CC=C(C=C2)F

Isomeric SMILES

CC(=O)CC(=O)C1=CN(C=N1)CC2=CC=C(C=C2)F

InChI

InChI=1S/C14H13FN2O2/c1-10(18)6-14(19)13-8-17(9-16-13)7-11-2-4-12(15)5-3-11/h2-5,8-9H,6-7H2,1H3