2-[4-[[2-(imidazol-1-ylmethyl)pyridin-3-yl]oxymethyl]phenyl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-[[2-(imidazol-1-ylmethyl)pyridin-3-yl]oxymethyl]phenyl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[[2-(imidazol-1-ylmethyl)-3-pyridyl]oxymethyl]phenyl]-2-oxo-acetic acid CAS Name: 2-[4-[[2-(1-imidazolylmethyl)-3-pyridinyl]oxymethyl]phenyl]-2-oxoacetic acid IUPAC Name: 2-[4-[[2-(imidazol-1-ylmethyl)pyridin-3-yl]oxymethyl]phenyl]-2-oxoacetic acid Traditional Name: 2-[4-[[2-(imidazol-1-ylmethyl)-3-pyridyl]oxymethyl]phenyl]-2-keto-acetic acid Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)CN2C=CN=C2)OCC3=CC=C(C=C3)C(=O)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)CN2C=CN=C2)OCC3=CC=C(C=C3)C(=O)C(=O)O

InChI

InChI=1S/C18H15N3O4/c22-17(18(23)24)14-5-3-13(4-6-14)11-25-16-2-1-7-20-15(16)10-21-9-8-19-12-21/h1-9,12H,10-11H2,(H,23,24)