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

Systemtic Name: 2-[4-(4-aminophenyl)phenyl]benzo[e]benzotriazole-6,8-disulfonic acid Openeye Name: 2-[4-(4-aminophenyl)phenyl]benzo[e]benzotriazole-6,8-disulfonic acid CAS Name: 2-[4-(4-aminophenyl)phenyl]benzo[e]benzotriazole-6,8-disulfonic acid IUPAC Name: 2-[4-(4-aminophenyl)phenyl]benzo[e]benzotriazole-6,8-disulfonic acid Traditional Name: 2-[4-(4-aminophenyl)phenyl]benzo[e]benzotriazole-6,8-disulfonic acid Formula: C22H16N4O6S2 MolecularWeight: 496.51564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)N3N=C4C=CC5=C(C=C(C=C5C4=N3)S(=O)(=O)O)S(=O)(=O)O)N

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)N3N=C4C=CC5=C(C=C(C=C5C4=N3)S(=O)(=O)O)S(=O)(=O)O)N

InChI

InChI=1S/C22H16N4O6S2/c23-15-5-1-13(2-6-15)14-3-7-16(8-4-14)26-24-20-10-9-18-19(22(20)25-26)11-17(33(27,28)29)12-21(18)34(30,31)32/h1-12H,23H2,(H,27,28,29)(H,30,31,32)