'N,N'-bis-(2-hydroxy-3-methyl-benzylidene)-benzene-1,2-diamine' (Q27459017)

2,2'-{1,2-Phenylenebis[nitrilo(E)methylylidene]}bis(6-methylphenol) (English)

19 October 2016

chemical formula

C₂₂H₂₀N₂O₂

1 reference

stated in

RCSB protein data bank

PDB ligand ID

CZM

16 February 2021

canonical SMILES

CC1=C(C(=CC=C1)C=NC2=C(C=CC=C2)N=CC3=C(C(=CC=C3)C)O)O

1 reference

2,2'-{1,2-Phenylenebis[nitrilo(E)methylylidene]}bis(6-methylphenol) (English)

19 October 2016

isomeric SMILES

CC1=C(C(=CC=C1)/C=N/C2=C(C=CC=C2)/N=C/C3=C(C(=CC=C3)C)O)O

1 reference

2,2'-{1,2-Phenylenebis[nitrilo(E)methylylidene]}bis(6-methylphenol) (English)

InChI=1S/C22H20N2O2/c1-15-7-5-9-17(21(15)25)13-23-19-11-3-4-12-20(19)24-14-18-10-6-8-16(2)22(18)26/h3-14,25-26H,1-2H3/b23-13+,24-14+

19 October 2016

Identifiers

InChI

1 reference

2,2'-{1,2-Phenylenebis[nitrilo(E)methylylidene]}bis(6-methylphenol) (English)

DNVUYVBRNCWGAK-RNIAWFEPSA-N

19 October 2016

InChIKey

1 reference

2,2'-{1,2-Phenylenebis[nitrilo(E)methylylidene]}bis(6-methylphenol) (English)

19 October 2016

1 reference

2,2'-{1,2-Phenylenebis[nitrilo(E)methylylidene]}bis(6-methylphenol) (English)

19 October 2016

0 references

1 reference

1UFJ (English)

19 October 2016

1 reference

1J3F (English)

19 October 2016

1 reference

1V9Q (English)