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

Systemtic Name: 2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)tetradecanenitrile Openeye Name: 2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)tetradecanenitrile CAS Name: 2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)tetradecanenitrile IUPAC Name: 2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)tetradecanenitrile Traditional Name: 2-[6-(3-butoxyphenyl)-4-(methylamino)hexyl]-2-(3-methoxyphenyl)myristonitrile Formula: C38H60N2O2 MolecularWeight: 576.8952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H60N2O2/c1-5-7-9-10-11-12-13-14-15-16-27-38(32-39,34-21-18-23-36(31-34)41-4)28-19-22-35(40-3)26-25-33-20-17-24-37(30-33)42-29-8-6-2/h17-18,20-21,23-24,30-31,35,40H,5-16,19,22,25-29H2,1-4H3