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

Systemtic Name: 1,5-bis(azanyl)-2-(4-octoxyphenyl)-4,8-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 1,5-diamino-4,8-dihydroxy-2-(4-octoxyphenyl)anthracene-9,10-dione CAS Name: 1,5-diamino-4,8-dihydroxy-2-(4-octoxyphenyl)anthracene-9,10-dione IUPAC Name: 1,5-diamino-4,8-dihydroxy-2-(4-octoxyphenyl)anthracene-9,10-dione Traditional Name: 1,5-diamino-4,8-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(=C2N)C(=O)C4=C(C=CC(=C4C3=O)N)O)O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC(=C3C(=C2N)C(=O)C4=C(C=CC(=C4C3=O)N)O)O

InChI

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