3-[4-(4-ethenylphenyl)phenyl]-5-(4-octylphenyl)-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[4-(4-ethenylphenyl)phenyl]-5-(4-octylphenyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-(4-octylphenyl)-4-phenyl-5-[4-(4-vinylphenyl)phenyl]-1,2,4-triazole CAS Name: 3-[4-(4-ethenylphenyl)phenyl]-5-(4-octylphenyl)-4-phenyl-1,2,4-triazole IUPAC Name: 3-[4-(4-ethenylphenyl)phenyl]-5-(4-octylphenyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-(4-octylphenyl)-4-phenyl-5-[4-(4-vinylphenyl)phenyl]-1,2,4-triazole Formula: C36H37N3 MolecularWeight: 511.69908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C5=CC=C(C=C5)C=C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C5=CC=C(C=C5)C=C

InChI

InChI=1S/C36H37N3/c1-3-5-6-7-8-10-13-29-18-22-32(23-19-29)35-37-38-36(39(35)34-14-11-9-12-15-34)33-26-24-31(25-27-33)30-20-16-28(4-2)17-21-30/h4,9,11-12,14-27H,2-3,5-8,10,13H2,1H3