2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[ethyl(octyl)amino]-2-propan-2-yl-pentanenitrile

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[ethyl(octyl)amino]-2-propan-2-yl-pentanenitrile Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[ethyl(octyl)amino]-2-isopropyl-pentanenitrile CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[ethyl(octyl)amino]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[ethyl(octyl)amino]-2-propan-2-ylpentanenitrile Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[ethyl(octyl)amino]-2-isopropyl-valeronitrile Formula: C26H42N2O2 MolecularWeight: 414.62388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CC)CCCC(C#N)(C1=CC2=C(C=C1)OCCO2)C(C)C

Isomeric SMILES

CCCCCCCCN(CC)CCCC(C#N)(C1=CC2=C(C=C1)OCCO2)C(C)C

InChI

InChI=1S/C26H42N2O2/c1-5-7-8-9-10-11-16-28(6-2)17-12-15-26(21-27,22(3)4)23-13-14-24-25(20-23)30-19-18-29-24/h13-14,20,22H,5-12,15-19H2,1-4H3