2-(4-fluoranyl-3-nitro-phenyl)-1-[2-(4-methoxyphenyl)ethyl]benzimidazole-5-carboxylic acid

Systemtic Name: 2-(4-fluoranyl-3-nitro-phenyl)-1-[2-(4-methoxyphenyl)ethyl]benzimidazole-5-carboxylic acid Openeye Name: 2-(4-fluoro-3-nitro-phenyl)-1-[2-(4-methoxyphenyl)ethyl]benzimidazole-5-carboxylic acid CAS Name: 2-(4-fluoro-3-nitrophenyl)-1-[2-(4-methoxyphenyl)ethyl]-5-benzimidazolecarboxylic acid IUPAC Name: 2-(4-fluoro-3-nitrophenyl)-1-[2-(4-methoxyphenyl)ethyl]benzimidazole-5-carboxylic acid Traditional Name: 2-(4-fluoro-3-nitro-phenyl)-1-[2-(4-methoxyphenyl)ethyl]benzimidazole-5-carboxylic acid Formula: C23H18FN3O5 MolecularWeight: 435.404523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCN2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C23H18FN3O5/c1-32-17-6-2-14(3-7-17)10-11-26-20-9-5-16(23(28)29)12-19(20)25-22(26)15-4-8-18(24)21(13-15)27(30)31/h2-9,12-13H,10-11H2,1H3,(H,28,29)