lithium 3-[3-[(4-cyano-3-fluoranyl-phenyl)methyl]imidazol-4-yl]propanoate

Systemtic Name: lithium 3-[3-[(4-cyano-3-fluoranyl-phenyl)methyl]imidazol-4-yl]propanoate Openeye Name: lithium 3-[3-[(4-cyano-3-fluoro-phenyl)methyl]imidazol-4-yl]propanoate CAS Name: lithium 3-[3-[(4-cyano-3-fluorophenyl)methyl]-4-imidazolyl]propanoate IUPAC Name: lithium 3-[3-[(4-cyano-3-fluorophenyl)methyl]imidazol-4-yl]propanoate Traditional Name: lithium 3-[3-(4-cyano-3-fluoro-benzyl)imidazol-4-yl]propionate Formula: C14H11FLiN3O2 MolecularWeight: 279.195443

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].C1=CC(=C(C=C1CN2C=NC=C2CCC(=O)[O-])F)C#N

Isomeric SMILES

[Li+].C1=CC(=C(C=C1CN2C=NC=C2CCC(=O)[O-])F)C#N

InChI

InChI=1S/C14H12FN3O2.Li/c15-13-5-10(1-2-11(13)6-16)8-18-9-17-7-12(18)3-4-14(19)20;/h1-2,5,7,9H,3-4,8H2,(H,19,20);/q;+1/p-1