[(E)-2-[1-[(4-tert-butylphenyl)methyl]benzimidazol-2-yl]-1-(4-fluorophenyl)ethenyl] 4-fluoranylbenzoate

Systemtic Name: [(E)-2-[1-[(4-tert-butylphenyl)methyl]benzimidazol-2-yl]-1-(4-fluorophenyl)ethenyl] 4-fluoranylbenzoate Openeye Name: [(E)-2-[1-[(4-tert-butylphenyl)methyl]benzimidazol-2-yl]-1-(4-fluorophenyl)vinyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [(E)-2-[1-[(4-tert-butylphenyl)methyl]-2-benzimidazolyl]-1-(4-fluorophenyl)ethenyl] ester IUPAC Name: [(E)-2-[1-[(4-tert-butylphenyl)methyl]benzimidazol-2-yl]-1-(4-fluorophenyl)ethenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [(E)-2-[1-(4-tert-butylbenzyl)benzimidazol-2-yl]-1-(4-fluorophenyl)vinyl] ester Formula: C33H28F2N2O2 MolecularWeight: 522.584426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2C=C(C4=CC=C(C=C4)F)OC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2/C=C(\C4=CC=C(C=C4)F)/OC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C33H28F2N2O2/c1-33(2,3)25-14-8-22(9-15-25)21-37-29-7-5-4-6-28(29)36-31(37)20-30(23-10-16-26(34)17-11-23)39-32(38)24-12-18-27(35)19-13-24/h4-20H,21H2,1-3H3/b30-20+