1-nitro-4-oxidanyl-5,8-bis(phenylmethoxy)anthracene-9,10-dione

Systemtic Name: 1-nitro-4-oxidanyl-5,8-bis(phenylmethoxy)anthracene-9,10-dione Openeye Name: 1,4-dibenzyloxy-5-hydroxy-8-nitro-anthracene-9,10-dione CAS Name: 1-hydroxy-4-nitro-5,8-bis(phenylmethoxy)anthracene-9,10-dione IUPAC Name: 1-hydroxy-4-nitro-5,8-bis(phenylmethoxy)anthracene-9,10-dione Traditional Name: 1,4-dibenzoxy-5-hydroxy-8-nitro-9,10-anthraquinone Formula: C28H19NO7 MolecularWeight: 481.45296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C3C(=C(C=C2)OCC4=CC=CC=C4)C(=O)C5=C(C=CC(=C5C3=O)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C3C(=C(C=C2)OCC4=CC=CC=C4)C(=O)C5=C(C=CC(=C5C3=O)[N+](=O)[O-])O

InChI

InChI=1S/C28H19NO7/c30-20-12-11-19(29(33)34)23-24(20)28(32)26-22(36-16-18-9-5-2-6-10-18)14-13-21(25(26)27(23)31)35-15-17-7-3-1-4-8-17/h1-14,30H,15-16H2