2-hexyl-1-[4-[[4-(4-octoxyphenyl)phenyl]methoxy]phenyl]cyclopropane-1-carbonitrile

Systemtic Name: 2-hexyl-1-[4-[[4-(4-octoxyphenyl)phenyl]methoxy]phenyl]cyclopropane-1-carbonitrile Openeye Name: 2-hexyl-1-[4-[[4-(4-octoxyphenyl)phenyl]methoxy]phenyl]cyclopropanecarbonitrile CAS Name: 2-hexyl-1-[4-[[4-(4-octoxyphenyl)phenyl]methoxy]phenyl]-1-cyclopropanecarbonitrile IUPAC Name: 2-hexyl-1-[4-[[4-(4-octoxyphenyl)phenyl]methoxy]phenyl]cyclopropane-1-carbonitrile Traditional Name: 2-hexyl-1-[4-[4-(4-octoxyphenyl)benzyl]oxyphenyl]cyclopropanecarbonitrile Formula: C37H47NO2 MolecularWeight: 537.77458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)COC3=CC=C(C=C3)C4(CC4CCCCCC)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)COC3=CC=C(C=C3)C4(CC4CCCCCC)C#N

InChI

InChI=1S/C37H47NO2/c1-3-5-7-9-10-12-26-39-35-22-18-32(19-23-35)31-16-14-30(15-17-31)28-40-36-24-20-33(21-25-36)37(29-38)27-34(37)13-11-8-6-4-2/h14-25,34H,3-13,26-28H2,1-2H3