1,4-bis(oxidanyl)-2-(pyridin-3-ylmethyl)anthracene-9,10-dione

Systemtic Name: 1,4-bis(oxidanyl)-2-(pyridin-3-ylmethyl)anthracene-9,10-dione Openeye Name: 1,4-dihydroxy-2-(3-pyridylmethyl)anthracene-9,10-dione CAS Name: 1,4-dihydroxy-2-(3-pyridinylmethyl)anthracene-9,10-dione IUPAC Name: 1,4-dihydroxy-2-(pyridin-3-ylmethyl)anthracene-9,10-dione Traditional Name: 1,4-dihydroxy-2-(3-pyridylmethyl)-9,10-anthraquinone Formula: C20H13NO4 MolecularWeight: 331.32152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=C(C(=C3C2=O)O)CC4=CN=CC=C4)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=C(C(=C3C2=O)O)CC4=CN=CC=C4)O

InChI

InChI=1S/C20H13NO4/c22-15-9-12(8-11-4-3-7-21-10-11)18(23)17-16(15)19(24)13-5-1-2-6-14(13)20(17)25/h1-7,9-10,22-23H,8H2