2-[2-methoxy-4-(3-methoxyphenyl)phenyl]-9-oxidanyl-3H-benzo[e]benzimidazole-7-sulfonic acid

Systemtic Name: 2-[2-methoxy-4-(3-methoxyphenyl)phenyl]-9-oxidanyl-3H-benzo[e]benzimidazole-7-sulfonic acid Openeye Name: 9-hydroxy-2-[2-methoxy-4-(3-methoxyphenyl)phenyl]-3H-benzo[e]benzimidazole-7-sulfonic acid CAS Name: 9-hydroxy-2-[2-methoxy-4-(3-methoxyphenyl)phenyl]-3H-benzo[e]benzimidazole-7-sulfonic acid IUPAC Name: 9-hydroxy-2-[2-methoxy-4-(3-methoxyphenyl)phenyl]-3H-benzo[e]benzimidazole-7-sulfonic acid Traditional Name: 9-hydroxy-2-[2-methoxy-4-(3-methoxyphenyl)phenyl]-3H-benzo[e]benzimidazole-7-sulfonic acid Formula: C25H20N2O6S MolecularWeight: 476.5011

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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