3-(4-pentoxyphenyl)-2-(4-pentylcyclohexyl)propanenitrile

Systemtic Name: 3-(4-pentoxyphenyl)-2-(4-pentylcyclohexyl)propanenitrile Openeye Name: 3-(4-pentoxyphenyl)-2-(4-pentylcyclohexyl)propanenitrile CAS Name: 3-(4-pentoxyphenyl)-2-(4-pentylcyclohexyl)propanenitrile IUPAC Name: 3-(4-pentoxyphenyl)-2-(4-pentylcyclohexyl)propanenitrile Traditional Name: 3-(4-amoxyphenyl)-2-(4-amylcyclohexyl)propionitrile Formula: C25H39NO MolecularWeight: 369.58326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C(CC2=CC=C(C=C2)OCCCCC)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C(CC2=CC=C(C=C2)OCCCCC)C#N

InChI

InChI=1S/C25H39NO/c1-3-5-7-9-21-10-14-23(15-11-21)24(20-26)19-22-12-16-25(17-13-22)27-18-8-6-4-2/h12-13,16-17,21,23-24H,3-11,14-15,18-19H2,1-2H3