2-(4-methylphenyl)benzo[e]benzotriazole-6,8-disulfonic acid

Systemtic Name: 2-(4-methylphenyl)benzo[e]benzotriazole-6,8-disulfonic acid Openeye Name: 2-(p-tolyl)benzo[e]benzotriazole-6,8-disulfonic acid CAS Name: 2-(4-methylphenyl)benzo[e]benzotriazole-6,8-disulfonic acid IUPAC Name: 2-(4-methylphenyl)benzo[e]benzotriazole-6,8-disulfonic acid Traditional Name: 2-(p-tolyl)benzo[e]benzotriazole-6,8-disulfonic acid Formula: C17H13N3O6S2 MolecularWeight: 419.43162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C=CC4=C(C=C(C=C4C3=N2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C=CC4=C(C=C(C=C4C3=N2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C17H13N3O6S2/c1-10-2-4-11(5-3-10)20-18-15-7-6-13-14(17(15)19-20)8-12(27(21,22)23)9-16(13)28(24,25)26/h2-9H,1H3,(H,21,22,23)(H,24,25,26)