1-[[2-(2,5-dimethylphenyl)oxiran-2-yl]-(4-fluorophenyl)methyl]benzotriazole

Systemtic Name: 1-[[2-(2,5-dimethylphenyl)oxiran-2-yl]-(4-fluorophenyl)methyl]benzotriazole Openeye Name: 1-[[2-(2,5-dimethylphenyl)oxiran-2-yl]-(4-fluorophenyl)methyl]benzotriazole CAS Name: 1-[[2-(2,5-dimethylphenyl)-2-oxiranyl]-(4-fluorophenyl)methyl]benzotriazole IUPAC Name: 1-[[2-(2,5-dimethylphenyl)oxiran-2-yl]-(4-fluorophenyl)methyl]benzotriazole Traditional Name: 1-[[2-(2,5-dimethylphenyl)oxiran-2-yl]-(4-fluorophenyl)methyl]benzotriazole Formula: C23H20FN3O MolecularWeight: 373.422803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2(CO2)C(C3=CC=C(C=C3)F)N4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2(CO2)C(C3=CC=C(C=C3)F)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C23H20FN3O/c1-15-7-8-16(2)19(13-15)23(14-28-23)22(17-9-11-18(24)12-10-17)27-21-6-4-3-5-20(21)25-26-27/h3-13,22H,14H2,1-2H3