3-methoxy-1-oxidanyl-2-(phenylmethyl)anthracene-9,10-dione

Systemtic Name: 3-methoxy-1-oxidanyl-2-(phenylmethyl)anthracene-9,10-dione Openeye Name: 2-benzyl-1-hydroxy-3-methoxy-anthracene-9,10-dione CAS Name: 1-hydroxy-3-methoxy-2-(phenylmethyl)anthracene-9,10-dione IUPAC Name: 2-benzyl-1-hydroxy-3-methoxyanthracene-9,10-dione Traditional Name: 2-benzyl-1-hydroxy-3-methoxy-9,10-anthraquinone Formula: C22H16O4 MolecularWeight: 344.36004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)O)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=O)C3=CC=CC=C3C2=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C22H16O4/c1-26-18-12-17-19(21(24)15-10-6-5-9-14(15)20(17)23)22(25)16(18)11-13-7-3-2-4-8-13/h2-10,12,25H,11H2,1H3