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

Systemtic Name: 1,2-bis(azanyl)-2,3-bis(4-octoxyphenoxy)-1H-anthracene-9,10-dione Openeye Name: 1,2-diamino-2,3-bis(4-octoxyphenoxy)-1H-anthracene-9,10-dione CAS Name: 1,2-diamino-2,3-bis(4-octoxyphenoxy)-1H-anthracene-9,10-dione IUPAC Name: 1,2-diamino-2,3-bis(4-octoxyphenoxy)-1H-anthracene-9,10-dione Traditional Name: 1,2-diamino-2,3-bis(4-octoxyphenoxy)-1H-anthracene-9,10-quinone Formula: C42H52N2O6 MolecularWeight: 680.87208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)OC2=CC3=C(C(C2(N)OC4=CC=C(C=C4)OCCCCCCCC)N)C(=O)C5=CC=CC=C5C3=O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)OC2=CC3=C(C(C2(N)OC4=CC=C(C=C4)OCCCCCCCC)N)C(=O)C5=CC=CC=C5C3=O

InChI

InChI=1S/C42H52N2O6/c1-3-5-7-9-11-15-27-47-30-19-23-32(24-20-30)49-37-29-36-38(40(46)35-18-14-13-17-34(35)39(36)45)41(43)42(37,44)50-33-25-21-31(22-26-33)48-28-16-12-10-8-6-4-2/h13-14,17-26,29,41H,3-12,15-16,27-28,43-44H2,1-2H3