1-[1-[4-(4-octoxyphenyl)cyclohexyl]ethyl]-4-octyl-cyclohexane-1-carbonitrile

Systemtic Name: 1-[1-[4-(4-octoxyphenyl)cyclohexyl]ethyl]-4-octyl-cyclohexane-1-carbonitrile Openeye Name: 1-[1-[4-(4-octoxyphenyl)cyclohexyl]ethyl]-4-octyl-cyclohexanecarbonitrile CAS Name: 1-[1-[4-(4-octoxyphenyl)cyclohexyl]ethyl]-4-octyl-1-cyclohexanecarbonitrile IUPAC Name: 1-[1-[4-(4-octoxyphenyl)cyclohexyl]ethyl]-4-octylcyclohexane-1-carbonitrile Traditional Name: 1-[1-[4-(4-octoxyphenyl)cyclohexyl]ethyl]-4-octyl-cyclohexanecarbonitrile Formula: C37H61NO MolecularWeight: 535.88634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)(C#N)C(C)C2CCC(CC2)C3=CC=C(C=C3)OCCCCCCCC

Isomeric SMILES

CCCCCCCCC1CCC(CC1)(C#N)C(C)C2CCC(CC2)C3=CC=C(C=C3)OCCCCCCCC

InChI

InChI=1S/C37H61NO/c1-4-6-8-10-12-14-16-32-25-27-37(30-38,28-26-32)31(3)33-17-19-34(20-18-33)35-21-23-36(24-22-35)39-29-15-13-11-9-7-5-2/h21-24,31-34H,4-20,25-29H2,1-3H3