1-[(4-tert-butylphenyl)methyl]-2-(6-fluoranyl-3,4-dihydro-2H-chromen-2-yl)benzimidazole

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-2-(6-fluoranyl-3,4-dihydro-2H-chromen-2-yl)benzimidazole Openeye Name: 1-[(4-tert-butylphenyl)methyl]-2-(6-fluorochroman-2-yl)benzimidazole CAS Name: 1-[(4-tert-butylphenyl)methyl]-2-(6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl)benzimidazole IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-2-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)benzimidazole Traditional Name: 1-(4-tert-butylbenzyl)-2-(6-fluorochroman-2-yl)benzimidazole Formula: C27H27FN2O MolecularWeight: 414.514483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2C4CCC5=C(O4)C=CC(=C5)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2C4CCC5=C(O4)C=CC(=C5)F

InChI

InChI=1S/C27H27FN2O/c1-27(2,3)20-11-8-18(9-12-20)17-30-23-7-5-4-6-22(23)29-26(30)25-14-10-19-16-21(28)13-15-24(19)31-25/h4-9,11-13,15-16,25H,10,14,17H2,1-3H3