1,4-bis(oxidanyl)-5,8-bis[3-oxidanyldecan-2-yl(propyl)amino]anthracene-9,10-dione

Systemtic Name: 1,4-bis(oxidanyl)-5,8-bis[3-oxidanyldecan-2-yl(propyl)amino]anthracene-9,10-dione Openeye Name: 1,4-dihydroxy-5,8-bis[(2-hydroxy-1-methyl-nonyl)-propyl-amino]anthracene-9,10-dione CAS Name: 1,4-dihydroxy-5,8-bis[3-hydroxydecan-2-yl(propyl)amino]anthracene-9,10-dione IUPAC Name: 1,4-dihydroxy-5,8-bis[3-hydroxydecan-2-yl(propyl)amino]anthracene-9,10-dione Traditional Name: 1,4-dihydroxy-5,8-bis[(2-hydroxy-1-methyl-nonyl)-propyl-amino]-9,10-anthraquinone Formula: C40H62N2O6 MolecularWeight: 666.93008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(C)N(CCC)C1=C2C(=C(C=C1)N(CCC)C(C)C(CCCCCCC)O)C(=O)C3=C(C=CC(=C3C2=O)O)O)O

Isomeric SMILES

CCCCCCCC(C(C)N(CCC)C1=C2C(=C(C=C1)N(CCC)C(C)C(CCCCCCC)O)C(=O)C3=C(C=CC(=C3C2=O)O)O)O

InChI

InChI=1S/C40H62N2O6/c1-7-11-13-15-17-19-31(43)27(5)41(25-9-3)29-21-22-30(42(26-10-4)28(6)32(44)20-18-16-14-12-8-2)36-35(29)39(47)37-33(45)23-24-34(46)38(37)40(36)48/h21-24,27-28,31-32,43-46H,7-20,25-26H2,1-6H3