4-(1-oxidanylidene-2,3-dihydroinden-5-yl)-5-pyridin-4-yl-1H-imidazole-2-carboxylic acid

Systemtic Name: 4-(1-oxidanylidene-2,3-dihydroinden-5-yl)-5-pyridin-4-yl-1H-imidazole-2-carboxylic acid Openeye Name: 4-(1-oxoindan-5-yl)-5-(4-pyridyl)-1H-imidazole-2-carboxylic acid CAS Name: 4-(1-oxo-2,3-dihydroinden-5-yl)-5-pyridin-4-yl-1H-imidazole-2-carboxylic acid IUPAC Name: 4-(1-oxo-2,3-dihydroinden-5-yl)-5-pyridin-4-yl-1H-imidazole-2-carboxylic acid Traditional Name: 4-(1-ketoindan-5-yl)-5-(4-pyridyl)-1H-imidazole-2-carboxylic acid Formula: C18H13N3O3 MolecularWeight: 319.31412

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=C1C=C(C=C2)C3=C(NC(=N3)C(=O)O)C4=CC=NC=C4

Isomeric SMILES

C1CC(=O)C2=C1C=C(C=C2)C3=C(NC(=N3)C(=O)O)C4=CC=NC=C4

InChI

InChI=1S/C18H13N3O3/c22-14-4-2-11-9-12(1-3-13(11)14)16-15(10-5-7-19-8-6-10)20-17(21-16)18(23)24/h1,3,5-9H,2,4H2,(H,20,21)(H,23,24)