(4-nitrophenyl)methyl 9,10-bis(oxidanyl)anthracene-2-sulfonate

Systemtic Name: (4-nitrophenyl)methyl 9,10-bis(oxidanyl)anthracene-2-sulfonate Openeye Name: (4-nitrophenyl)methyl 9,10-dihydroxyanthracene-2-sulfonate CAS Name: 9,10-dihydroxy-2-anthracenesulfonic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 9,10-dihydroxyanthracene-2-sulfonate Traditional Name: 9,10-dihydroxyanthracene-2-sulfonic acid (4-nitrobenzyl) ester Formula: C21H15NO7S MolecularWeight: 425.4113

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC(=CC3=C2O)S(=O)(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC(=CC3=C2O)S(=O)(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C21H15NO7S/c23-20-16-3-1-2-4-17(16)21(24)19-11-15(9-10-18(19)20)30(27,28)29-12-13-5-7-14(8-6-13)22(25)26/h1-11,23-24H,12H2