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

Systemtic Name: 2-(3-hydroxyphenyl)-2-[6-(3-hydroxyphenyl)-4-(methylamino)hexyl]tetradecanenitrile Openeye Name: 2-(3-hydroxyphenyl)-2-[6-(3-hydroxyphenyl)-4-(methylamino)hexyl]tetradecanenitrile CAS Name: 2-(3-hydroxyphenyl)-2-[6-(3-hydroxyphenyl)-4-(methylamino)hexyl]tetradecanenitrile IUPAC Name: 2-(3-hydroxyphenyl)-2-[6-(3-hydroxyphenyl)-4-(methylamino)hexyl]tetradecanenitrile Traditional Name: 2-(3-hydroxyphenyl)-2-[6-(3-hydroxyphenyl)-4-(methylamino)hexyl]myristonitrile Formula: C33H50N2O2 MolecularWeight: 506.7623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H50N2O2/c1-3-4-5-6-7-8-9-10-11-12-23-33(27-34,29-17-14-20-32(37)26-29)24-15-18-30(35-2)22-21-28-16-13-19-31(36)25-28/h13-14,16-17,19-20,25-26,30,35-37H,3-12,15,18,21-24H2,1-2H3