U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry MIXED
Molecular Formula C36H34N8O4
Molecular Weight 642.7064
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 2
Charge 0
Stereo Comments Assumed racemic

SHOW SMILES / InChI
Structure of ALTERNATIVE DEFINITION for [PIGMENT RED 37]

SMILES

COC1=CC(=CC=C1\N=N\C2C(=O)N(N=C2C)C3=CC=C(C)C=C3)C4=CC=C(\N=N\C5C(=O)N(N=C5C)C6=CC=C(C)C=C6)C(OC)=C4

InChI

InChIKey=CMBVJWXIWKNGIL-HVMBLDELSA-N
InChI=1S/C36H34N8O4/c1-21-7-13-27(14-8-21)43-35(45)33(23(3)41-43)39-37-29-17-11-25(19-31(29)47-5)26-12-18-30(32(20-26)48-6)38-40-34-24(4)42-44(36(34)46)28-15-9-22(2)10-16-28/h7-20,33-34H,1-6H3/b39-37+,40-38+

HIDE SMILES / InChI

Approval Year