4-[(2,5-dimethylphenyl)methylidene]-2-(2-methylbutan-2-yl)-2,3-dihydro-1H-acridine-9-carboxylic acid

Systemtic Name: 4-[(2,5-dimethylphenyl)methylidene]-2-(2-methylbutan-2-yl)-2,3-dihydro-1H-acridine-9-carboxylic acid Openeye Name: 4-[(2,5-dimethylphenyl)methylene]-2-(1,1-dimethylpropyl)-2,3-dihydro-1H-acridine-9-carboxylic acid CAS Name: 4-[(2,5-dimethylphenyl)methylidene]-2-(2-methylbutan-2-yl)-2,3-dihydro-1H-acridine-9-carboxylic acid IUPAC Name: 4-[(2,5-dimethylphenyl)methylidene]-2-(2-methylbutan-2-yl)-2,3-dihydro-1H-acridine-9-carboxylic acid Traditional Name: 2-tert-amyl-4-(2,5-dimethylbenzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid Formula: C28H31NO2 MolecularWeight: 413.55124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CC(=CC2=C(C=CC(=C2)C)C)C3=NC4=CC=CC=C4C(=C3C1)C(=O)O

Isomeric SMILES

CCC(C)(C)C1CC(=CC2=C(C=CC(=C2)C)C)C3=NC4=CC=CC=C4C(=C3C1)C(=O)O

InChI

InChI=1S/C28H31NO2/c1-6-28(4,5)21-15-20(14-19-13-17(2)11-12-18(19)3)26-23(16-21)25(27(30)31)22-9-7-8-10-24(22)29-26/h7-14,21H,6,15-16H2,1-5H3,(H,30,31)