1,4-bis(azanyl)-2,3-bis(4-octoxyphenoxy)anthracene-9,10-dione

Systemtic Name: 1,4-bis(azanyl)-2,3-bis(4-octoxyphenoxy)anthracene-9,10-dione Openeye Name: 1,4-diamino-2,3-bis(4-octoxyphenoxy)anthracene-9,10-dione CAS Name: 1,4-diamino-2,3-bis(4-octoxyphenoxy)anthracene-9,10-dione IUPAC Name: 1,4-diamino-2,3-bis(4-octoxyphenoxy)anthracene-9,10-dione Traditional Name: 1,4-diamino-2,3-bis(4-octoxyphenoxy)-9,10-anthraquinone Formula: C42H50N2O6 MolecularWeight: 678.8562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)OC2=C(C3=C(C(=C2OC4=CC=C(C=C4)OCCCCCCCC)N)C(=O)C5=CC=CC=C5C3=O)N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)OC2=C(C3=C(C(=C2OC4=CC=C(C=C4)OCCCCCCCC)N)C(=O)C5=CC=CC=C5C3=O)N

InChI

InChI=1S/C42H50N2O6/c1-3-5-7-9-11-15-27-47-29-19-23-31(24-20-29)49-41-37(43)35-36(40(46)34-18-14-13-17-33(34)39(35)45)38(44)42(41)50-32-25-21-30(22-26-32)48-28-16-12-10-8-6-4-2/h13-14,17-26H,3-12,15-16,27-28,43-44H2,1-2H3