5-(4-butoxyphenyl)-3-[4-(4-pentylcyclohexyl)phenyl]-1,2,4-oxadiazole

Systemtic Name: 5-(4-butoxyphenyl)-3-[4-(4-pentylcyclohexyl)phenyl]-1,2,4-oxadiazole Openeye Name: 5-(4-butoxyphenyl)-3-[4-(4-pentylcyclohexyl)phenyl]-1,2,4-oxadiazole CAS Name: 5-(4-butoxyphenyl)-3-[4-(4-pentylcyclohexyl)phenyl]-1,2,4-oxadiazole IUPAC Name: 5-(4-butoxyphenyl)-3-[4-(4-pentylcyclohexyl)phenyl]-1,2,4-oxadiazole Traditional Name: 3-[4-(4-amylcyclohexyl)phenyl]-5-(4-butoxyphenyl)-1,2,4-oxadiazole Formula: C29H38N2O2 MolecularWeight: 446.62422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=NOC(=N3)C4=CC=C(C=C4)OCCCC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=NOC(=N3)C4=CC=C(C=C4)OCCCC

InChI

InChI=1S/C29H38N2O2/c1-3-5-7-8-22-9-11-23(12-10-22)24-13-15-25(16-14-24)28-30-29(33-31-28)26-17-19-27(20-18-26)32-21-6-4-2/h13-20,22-23H,3-12,21H2,1-2H3