2-(3-butoxyphenyl)-2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]tetradecanenitrile

Systemtic Name: 2-(3-butoxyphenyl)-2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]tetradecanenitrile Openeye Name: 2-(3-butoxyphenyl)-2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]tetradecanenitrile CAS Name: 2-(3-butoxyphenyl)-2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]tetradecanenitrile IUPAC Name: 2-(3-butoxyphenyl)-2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]tetradecanenitrile Traditional Name: 2-(3-butoxyphenyl)-2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]myristonitrile Formula: C41H66N2O2 MolecularWeight: 618.97494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCC(CCC1=CC(=CC=C1)OCCCC)NC)(C#N)C2=CC(=CC=C2)OCCCC

Isomeric SMILES

CCCCCCCCCCCCC(CCCC(CCC1=CC(=CC=C1)OCCCC)NC)(C#N)C2=CC(=CC=C2)OCCCC

InChI

InChI=1S/C41H66N2O2/c1-5-8-11-12-13-14-15-16-17-18-29-41(35-42,37-23-20-26-40(34-37)45-32-10-7-3)30-21-24-38(43-4)28-27-36-22-19-25-39(33-36)44-31-9-6-2/h19-20,22-23,25-26,33-34,38,43H,5-18,21,24,27-32H2,1-4H3