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

Systemtic Name: 4,8-bis(azanyl)-2-(4-octoxyphenyl)-1,5-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 4,8-diamino-1,5-dihydroxy-2-(4-octoxyphenyl)anthracene-9,10-dione CAS Name: 4,8-diamino-1,5-dihydroxy-2-(4-octoxyphenyl)anthracene-9,10-dione IUPAC Name: 4,8-diamino-1,5-dihydroxy-2-(4-octoxyphenyl)anthracene-9,10-dione Traditional Name: 4,8-diamino-1,5-dihydroxy-2-(4-octoxyphenyl)-9,10-anthraquinone Formula: C28H30N2O5 MolecularWeight: 474.5482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC(=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)N)N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC(=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)N)N

InChI

InChI=1S/C28H30N2O5/c1-2-3-4-5-6-7-14-35-17-10-8-16(9-11-17)18-15-20(30)23-25(26(18)32)28(34)22-19(29)12-13-21(31)24(22)27(23)33/h8-13,15,31-32H,2-7,14,29-30H2,1H3