1,8-bis[(10-dodecylanthracen-9-yl)methoxy]anthracene-9,10-dione

Systemtic Name: 1,8-bis[(10-dodecylanthracen-9-yl)methoxy]anthracene-9,10-dione Openeye Name: 1,8-bis[(10-dodecyl-9-anthryl)methoxy]anthracene-9,10-dione CAS Name: 1,8-bis[(10-dodecyl-9-anthracenyl)methoxy]anthracene-9,10-dione IUPAC Name: 1,8-bis[(10-dodecylanthracen-9-yl)methoxy]anthracene-9,10-dione Traditional Name: 1,8-bis[(10-lauryl-9-anthryl)methoxy]-9,10-anthraquinone Formula: C68H76O4 MolecularWeight: 957.32864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C2C=CC=CC2=C(C3=CC=CC=C31)COC4=CC=CC5=C4C(=O)C6=C(C5=O)C=CC=C6OCC7=C8C=CC=CC8=C(C9=CC=CC=C97)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=C2C=CC=CC2=C(C3=CC=CC=C31)COC4=CC=CC5=C4C(=O)C6=C(C5=O)C=CC=C6OCC7=C8C=CC=CC8=C(C9=CC=CC=C97)CCCCCCCCCCCC

InChI

InChI=1S/C68H76O4/c1-3-5-7-9-11-13-15-17-19-21-33-49-51-35-23-27-39-55(51)61(56-40-28-24-36-52(49)56)47-71-63-45-31-43-59-65(63)68(70)66-60(67(59)69)44-32-46-64(66)72-48-62-57-41-29-25-37-53(57)50(54-38-26-30-42-58(54)62)34-22-20-18-16-14-12-10-8-6-4-2/h23-32,35-46H,3-22,33-34,47-48H2,1-2H3