4-[[2-oxidanylidene-3-(pyridin-3-ylmethyl)imidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2-oxidanylidene-3-(pyridin-3-ylmethyl)imidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[2-oxo-3-(3-pyridylmethyl)imidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[2-oxo-3-(3-pyridinylmethyl)-1-imidazolyl]methyl]benzoic acid IUPAC Name: 4-[[2-oxo-3-(pyridin-3-ylmethyl)imidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[2-keto-3-(3-pyridylmethyl)-4-imidazolin-1-yl]methyl]benzoic acid Formula: C17H15N3O3 MolecularWeight: 309.3193

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN2C=CN(C2=O)CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CN2C=CN(C2=O)CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H15N3O3/c21-16(22)15-5-3-13(4-6-15)11-19-8-9-20(17(19)23)12-14-2-1-7-18-10-14/h1-10H,11-12H2,(H,21,22)