2-nitro-3-[(E)-2-(3-sulfophenyl)ethenyl]benzenesulfonic acid

Systemtic Name: 2-nitro-3-[(E)-2-(3-sulfophenyl)ethenyl]benzenesulfonic acid Openeye Name: 2-nitro-3-[(E)-2-(3-sulfophenyl)vinyl]benzenesulfonic acid CAS Name: 2-nitro-3-[(E)-2-(3-sulfophenyl)ethenyl]benzenesulfonic acid IUPAC Name: 2-nitro-3-[(E)-2-(3-sulfophenyl)ethenyl]benzenesulfonic acid Traditional Name: 2-nitro-3-[(E)-2-(3-sulfophenyl)vinyl]besylic acid Formula: C14H11NO8S2 MolecularWeight: 385.36904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO8S2/c16-15(17)14-11(4-2-6-13(14)25(21,22)23)8-7-10-3-1-5-12(9-10)24(18,19)20/h1-9H,(H,18,19,20)(H,21,22,23)/b8-7+