2-(4-pentoxyphenyl)-2-propoxy-hexanenitrile

Systemtic Name: 2-(4-pentoxyphenyl)-2-propoxy-hexanenitrile Openeye Name: 2-(4-pentoxyphenyl)-2-propoxy-hexanenitrile CAS Name: 2-(4-pentoxyphenyl)-2-propoxyhexanenitrile IUPAC Name: 2-(4-pentoxyphenyl)-2-propoxyhexanenitrile Traditional Name: 2-(4-amoxyphenyl)-2-propoxy-hexanenitrile Formula: C20H31NO2 MolecularWeight: 317.46564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(CCCC)(C#N)OCCC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(CCCC)(C#N)OCCC

InChI

InChI=1S/C20H31NO2/c1-4-7-9-16-22-19-12-10-18(11-13-19)20(17-21,14-8-5-2)23-15-6-3/h10-13H,4-9,14-16H2,1-3H3