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5-[4-(4-octylphenyl)phenyl]-3-(phenylmethyl)-1,2,4-oxadiazole

5-[4-(4-octylphenyl)phenyl]-3-(phenylmethyl)-1,2,4-oxadiazole

Systemtic Name:5-[4-(4-octylphenyl)phenyl]-3-(phenylmethyl)-1,2,4-oxadiazole
Openeye Name:3-benzyl-5-[4-(4-octylphenyl)phenyl]-1,2,4-oxadiazole
CAS Name:5-[4-(4-octylphenyl)phenyl]-3-(phenylmethyl)-1,2,4-oxadiazole
IUPAC Name:3-benzyl-5-[4-(4-octylphenyl)phenyl]-1,2,4-oxadiazole
Traditional Name:3-benzyl-5-[4-(4-octylphenyl)phenyl]-1,2,4-oxadiazole
Formula: C29H32N2O
MolecularWeight: 424.57718
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC(=NO3)CC4=CC=CC=C4


Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC(=NO3)CC4=CC=CC=C4


InChI

InChI=1S/C29H32N2O/c1-2-3-4-5-6-8-11-23-14-16-25(17-15-23)26-18-20-27(21-19-26)29-30-28(31-32-29)22-24-12-9-7-10-13-24/h7,9-10,12-21H,2-6,8,11,22H2,1H3


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