2-nitro-5-[(E)-2-(4-nitro-3-sulfo-phenyl)ethenyl]benzenesulfonic acid

Systemtic Name: 2-nitro-5-[(E)-2-(4-nitro-3-sulfo-phenyl)ethenyl]benzenesulfonic acid Openeye Name: 2-nitro-5-[(E)-2-(4-nitro-3-sulfo-phenyl)vinyl]benzenesulfonic acid CAS Name: 2-nitro-5-[(E)-2-(4-nitro-3-sulfophenyl)ethenyl]benzenesulfonic acid IUPAC Name: 2-nitro-5-[(E)-2-(4-nitro-3-sulfophenyl)ethenyl]benzenesulfonic acid Traditional Name: 2-nitro-5-[(E)-2-(4-nitro-3-sulfo-phenyl)vinyl]besylic acid Formula: C14H10N2O10S2 MolecularWeight: 430.3666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC2=CC(=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1/C=C/C2=CC(=C(C=C2)[N+](=O)[O-])S(=O)(=O)O)S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O10S2/c17-15(18)11-5-3-9(7-13(11)27(21,22)23)1-2-10-4-6-12(16(19)20)14(8-10)28(24,25)26/h1-8H,(H,21,22,23)(H,24,25,26)/b2-1+