[(R)-[1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]-phenyl-methyl] 2-nitrobenzoate

Systemtic Name: [(R)-[1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]-phenyl-methyl] 2-nitrobenzoate Openeye Name: [(R)-[1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]-phenyl-methyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [(R)-[1-[(2-fluorophenyl)methyl]-2-benzimidazolyl]-phenylmethyl] ester IUPAC Name: [(R)-[1-[(2-fluorophenyl)methyl]benzimidazol-2-yl]-phenylmethyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [(R)-[1-(2-fluorobenzyl)benzimidazol-2-yl]-phenyl-methyl] ester Formula: C28H20FN3O4 MolecularWeight: 481.474503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=NC3=CC=CC=C3N2CC4=CC=CC=C4F)OC(=O)C5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C2=NC3=CC=CC=C3N2CC4=CC=CC=C4F)OC(=O)C5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C28H20FN3O4/c29-22-14-6-4-12-20(22)18-31-25-17-9-7-15-23(25)30-27(31)26(19-10-2-1-3-11-19)36-28(33)21-13-5-8-16-24(21)32(34)35/h1-17,26H,18H2/t26-/m1/s1