5,7-dinitro-8-(phenylsulfonyloxy)naphthalene-2-sulfonic acid

Systemtic Name: 5,7-dinitro-8-(phenylsulfonyloxy)naphthalene-2-sulfonic acid Openeye Name: 8-(benzenesulfonyloxy)-5,7-dinitro-naphthalene-2-sulfonic acid CAS Name: 8-(benzenesulfonyloxy)-5,7-dinitro-2-naphthalenesulfonic acid IUPAC Name: 8-(benzenesulfonyloxy)-5,7-dinitronaphthalene-2-sulfonic acid Traditional Name: 8-besyloxy-5,7-dinitro-naphthalene-2-sulfonic acid Formula: C16H10N2O10S2 MolecularWeight: 454.388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C3=C2C=C(C=C3)S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C3=C2C=C(C=C3)S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O10S2/c19-17(20)14-9-15(18(21)22)16(28-30(26,27)10-4-2-1-3-5-10)13-8-11(29(23,24)25)6-7-12(13)14/h1-9H,(H,23,24,25)