2-ethoxy-3-[[3-(1,2,4-oxadiazol-3-yl)-6-oxidanylidene-4-phenyl-cyclohexa-1,4-dien-1-yl]methyl]benzimidazole-4-carboxylic acid

Systemtic Name: 2-ethoxy-3-[[3-(1,2,4-oxadiazol-3-yl)-6-oxidanylidene-4-phenyl-cyclohexa-1,4-dien-1-yl]methyl]benzimidazole-4-carboxylic acid Openeye Name: 2-ethoxy-3-[[3-(1,2,4-oxadiazol-3-yl)-6-oxo-4-phenyl-cyclohexa-1,4-dien-1-yl]methyl]benzimidazole-4-carboxylic acid CAS Name: 2-ethoxy-3-[[3-(1,2,4-oxadiazol-3-yl)-6-oxo-4-phenyl-1-cyclohexa-1,4-dienyl]methyl]-4-benzimidazolecarboxylic acid IUPAC Name: 2-ethoxy-3-[[3-(1,2,4-oxadiazol-3-yl)-6-oxo-4-phenylcyclohexa-1,4-dien-1-yl]methyl]benzimidazole-4-carboxylic acid Traditional Name: 2-ethoxy-3-[[6-keto-3-(1,2,4-oxadiazol-3-yl)-4-phenyl-cyclohexa-1,4-dien-1-yl]methyl]benzimidazole-4-carboxylic acid Formula: C25H20N4O5 MolecularWeight: 456.4501

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=CC=CC(=C2N1CC3=CC(C(=CC3=O)C4=CC=CC=C4)C5=NOC=N5)C(=O)O

Isomeric SMILES

CCOC1=NC2=CC=CC(=C2N1CC3=CC(C(=CC3=O)C4=CC=CC=C4)C5=NOC=N5)C(=O)O

InChI

InChI=1S/C25H20N4O5/c1-2-33-25-27-20-10-6-9-17(24(31)32)22(20)29(25)13-16-11-19(23-26-14-34-28-23)18(12-21(16)30)15-7-4-3-5-8-15/h3-12,14,19H,2,13H2,1H3,(H,31,32)