disodium 2-[4-[(E)-2-phenylethenyl]-3-sulfo-phenyl]benzo[e]benzotriazole-7-sulfonic acid

Systemtic Name: disodium 2-[4-[(E)-2-phenylethenyl]-3-sulfo-phenyl]benzo[e]benzotriazole-7-sulfonic acid Openeye Name: disodium 2-[4-[(E)-styryl]-3-sulfo-phenyl]benzo[e]benzotriazole-7-sulfonic acid CAS Name: disodium 2-[4-[(E)-2-phenylethenyl]-3-sulfophenyl]-7-benzo[e]benzotriazolesulfonic acid IUPAC Name: disodium 2-[4-[(E)-2-phenylethenyl]-3-sulfophenyl]benzo[e]benzotriazole-7-sulfonic acid Traditional Name: disodium 2-[4-[(E)-styryl]-3-sulfo-phenyl]benzo[e]benzotriazole-7-sulfonic acid Formula: C24H17N3Na2O6S2+2 MolecularWeight: 553.51782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=C(C=C(C=C2)N3N=C4C=CC5=C(C4=N3)C=CC(=C5)S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=C(C=C(C=C2)N3N=C4C=CC5=C(C4=N3)C=CC(=C5)S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+]

InChI

InChI=1S/C24H17N3O6S2.2Na/c28-34(29,30)20-11-12-21-18(14-20)9-13-22-24(21)26-27(25-22)19-10-8-17(23(15-19)35(31,32)33)7-6-16-4-2-1-3-5-16;;/h1-15H,(H,28,29,30)(H,31,32,33);;/q;2*+1/b7-6+;;