9-oxidanyl-2-(4-phenylphenyl)-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride

Systemtic Name: 9-oxidanyl-2-(4-phenylphenyl)-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride Openeye Name: 9-hydroxy-2-(4-phenylphenyl)-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride CAS Name: 9-hydroxy-2-(4-phenylphenyl)-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride IUPAC Name: 9-hydroxy-2-(4-phenylphenyl)-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride Traditional Name: 9-hydroxy-2-(4-phenylphenyl)-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride Formula: C23H17ClN2O4S MolecularWeight: 452.91008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC4=C(N3)C=CC5=CC(=CC(=C54)O)S(=O)(=O)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC4=C(N3)C=CC5=CC(=CC(=C54)O)S(=O)(=O)O.Cl

InChI

InChI=1S/C23H16N2O4S.ClH/c26-20-13-18(30(27,28)29)12-17-10-11-19-22(21(17)20)25-23(24-19)16-8-6-15(7-9-16)14-4-2-1-3-5-14;/h1-13,26H,(H,24,25)(H,27,28,29);1H