(2E)-2-[6-(4-tert-butylphenyl)-1H-pyridin-2-ylidene]-9-oxidanylidene-1H-benzo[e]benzimidazole-7-carboxylic acid

Systemtic Name: (2E)-2-[6-(4-tert-butylphenyl)-1H-pyridin-2-ylidene]-9-oxidanylidene-1H-benzo[e]benzimidazole-7-carboxylic acid Openeye Name: (2E)-2-[6-(4-tert-butylphenyl)-1H-pyridin-2-ylidene]-9-oxo-1H-benzo[e]benzimidazole-7-carboxylic acid CAS Name: (2E)-2-[6-(4-tert-butylphenyl)-1H-pyridin-2-ylidene]-9-oxo-1H-benzo[e]benzimidazole-7-carboxylic acid IUPAC Name: (2E)-2-[6-(4-tert-butylphenyl)-1H-pyridin-2-ylidene]-9-oxo-1H-benzo[e]benzimidazole-7-carboxylic acid Traditional Name: (2E)-2-[6-(4-tert-butylphenyl)-1H-pyridin-2-ylidene]-9-keto-1H-benzo[e]benzimidazole-7-carboxylic acid Formula: C27H23N3O3 MolecularWeight: 437.48982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC=CC(=C3NC4=C5C(=CC(=CC5=O)C(=O)O)C=CC4=N3)N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC=C/C(=C\3/NC4=C5C(=CC(=CC5=O)C(=O)O)C=CC4=N3)/N2

InChI

InChI=1S/C27H23N3O3/c1-27(2,3)18-10-7-15(8-11-18)19-5-4-6-21(28-19)25-29-20-12-9-16-13-17(26(32)33)14-22(31)23(16)24(20)30-25/h4-14,28,30H,1-3H3,(H,32,33)/b25-21-