2-[2-methoxy-3-(3-methoxyphenyl)phenyl]-9-oxidanyl-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride

Systemtic Name: 2-[2-methoxy-3-(3-methoxyphenyl)phenyl]-9-oxidanyl-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride Openeye Name: 9-hydroxy-2-[2-methoxy-3-(3-methoxyphenyl)phenyl]-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride CAS Name: 9-hydroxy-2-[2-methoxy-3-(3-methoxyphenyl)phenyl]-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride IUPAC Name: 9-hydroxy-2-[2-methoxy-3-(3-methoxyphenyl)phenyl]-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride Traditional Name: 9-hydroxy-2-[2-methoxy-3-(3-methoxyphenyl)phenyl]-3H-benzo[e]benzimidazole-7-sulfonic acid hydrochloride Formula: C25H21ClN2O6S MolecularWeight: 512.96204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C(=CC=C2)C3=NC4=C(N3)C=CC5=CC(=CC(=C54)O)S(=O)(=O)O)OC.Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C(=CC=C2)C3=NC4=C(N3)C=CC5=CC(=CC(=C54)O)S(=O)(=O)O)OC.Cl

InChI

InChI=1S/C25H20N2O6S.ClH/c1-32-16-6-3-5-14(11-16)18-7-4-8-19(24(18)33-2)25-26-20-10-9-15-12-17(34(29,30)31)13-21(28)22(15)23(20)27-25;/h3-13,28H,1-2H3,(H,26,27)(H,29,30,31);1H