1,4-bis(2-ethylhexylamino)-5,8-bis(oxidanyl)anthracene-9,10-dione

Systemtic Name: 1,4-bis(2-ethylhexylamino)-5,8-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 1,4-bis(2-ethylhexylamino)-5,8-dihydroxy-anthracene-9,10-dione CAS Name: 1,4-bis(2-ethylhexylamino)-5,8-dihydroxyanthracene-9,10-dione IUPAC Name: 1,4-bis(2-ethylhexylamino)-5,8-dihydroxyanthracene-9,10-dione Traditional Name: 1,4-bis(2-ethylhexylamino)-5,8-dihydroxy-9,10-anthraquinone Formula: C30H42N2O4 MolecularWeight: 494.66548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC1=C2C(=C(C=C1)NCC(CC)CCCC)C(=O)C3=C(C=CC(=C3C2=O)O)O

Isomeric SMILES

CCCCC(CC)CNC1=C2C(=C(C=C1)NCC(CC)CCCC)C(=O)C3=C(C=CC(=C3C2=O)O)O

InChI

InChI=1S/C30H42N2O4/c1-5-9-11-19(7-3)17-31-21-13-14-22(32-18-20(8-4)12-10-6-2)26-25(21)29(35)27-23(33)15-16-24(34)28(27)30(26)36/h13-16,19-20,31-34H,5-12,17-18H2,1-4H3