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

Systemtic Name: 5-(3-nitrophenyl)-3-[4-(4-pentylcyclohexyl)phenyl]-1,2,4-oxadiazole Openeye Name: 5-(3-nitrophenyl)-3-[4-(4-pentylcyclohexyl)phenyl]-1,2,4-oxadiazole CAS Name: 5-(3-nitrophenyl)-3-[4-(4-pentylcyclohexyl)phenyl]-1,2,4-oxadiazole IUPAC Name: 5-(3-nitrophenyl)-3-[4-(4-pentylcyclohexyl)phenyl]-1,2,4-oxadiazole Traditional Name: 3-[4-(4-amylcyclohexyl)phenyl]-5-(3-nitrophenyl)-1,2,4-oxadiazole Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=NOC(=N3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=NOC(=N3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H29N3O3/c1-2-3-4-6-18-9-11-19(12-10-18)20-13-15-21(16-14-20)24-26-25(31-27-24)22-7-5-8-23(17-22)28(29)30/h5,7-8,13-19H,2-4,6,9-12H2,1H3