3-(1H-benzimidazol-2-yl)-1,8-bis(oxidanyl)anthracene-9,10-dione

Systemtic Name: 3-(1H-benzimidazol-2-yl)-1,8-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 3-(1H-benzimidazol-2-yl)-1,8-dihydroxy-anthracene-9,10-dione CAS Name: 3-(1H-benzimidazol-2-yl)-1,8-dihydroxyanthracene-9,10-dione IUPAC Name: 3-(1H-benzimidazol-2-yl)-1,8-dihydroxyanthracene-9,10-dione Traditional Name: 3-(1H-benzimidazol-2-yl)-1,8-dihydroxy-9,10-anthraquinone Formula: C21H12N2O4 MolecularWeight: 356.33098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=CC4=C(C(=C3)O)C(=O)C5=C(C4=O)C=CC=C5O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC4=C(C(=C3)O)C(=O)C5=C(C4=O)C=CC=C5O

InChI

InChI=1S/C21H12N2O4/c24-15-7-3-4-11-17(15)20(27)18-12(19(11)26)8-10(9-16(18)25)21-22-13-5-1-2-6-14(13)23-21/h1-9,24-25H,(H,22,23)