2-[3-(4-carboxy-3-methyl-phenyl)phenyl]-9-oxidanyl-3H-benzo[e]benzimidazole-7-carboxylic acid

Systemtic Name: 2-[3-(4-carboxy-3-methyl-phenyl)phenyl]-9-oxidanyl-3H-benzo[e]benzimidazole-7-carboxylic acid Openeye Name: 2-[3-(4-carboxy-3-methyl-phenyl)phenyl]-9-hydroxy-3H-benzo[e]benzimidazole-7-carboxylic acid CAS Name: 2-[3-(4-carboxy-3-methylphenyl)phenyl]-9-hydroxy-3H-benzo[e]benzimidazole-7-carboxylic acid IUPAC Name: 2-[3-(4-carboxy-3-methylphenyl)phenyl]-9-hydroxy-3H-benzo[e]benzimidazole-7-carboxylic acid Traditional Name: 2-[3-(4-carboxy-3-methyl-phenyl)phenyl]-9-hydroxy-3H-benzo[e]benzimidazole-7-carboxylic acid Formula: C26H18N2O5 MolecularWeight: 438.43152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=CC=C2)C3=NC4=C(N3)C=CC5=CC(=CC(=C54)O)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=CC=C2)C3=NC4=C(N3)C=CC5=CC(=CC(=C54)O)C(=O)O)C(=O)O

InChI

InChI=1S/C26H18N2O5/c1-13-9-15(5-7-19(13)26(32)33)14-3-2-4-17(10-14)24-27-20-8-6-16-11-18(25(30)31)12-21(29)22(16)23(20)28-24/h2-12,29H,1H3,(H,27,28)(H,30,31)(H,32,33)