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

Systemtic Name: 4-[(4-methoxycarbonylphenyl)methylidene]-2-(2-methylbutan-2-yl)-2,3-dihydro-1H-acridine-9-carboxylic acid Openeye Name: 2-(1,1-dimethylpropyl)-4-[(4-methoxycarbonylphenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylic acid CAS Name: 4-[(4-methoxycarbonylphenyl)methylidene]-2-(2-methylbutan-2-yl)-2,3-dihydro-1H-acridine-9-carboxylic acid IUPAC Name: 4-[(4-methoxycarbonylphenyl)methylidene]-2-(2-methylbutan-2-yl)-2,3-dihydro-1H-acridine-9-carboxylic acid Traditional Name: 2-tert-amyl-4-(4-carbomethoxybenzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29NO4/c1-5-28(2,3)20-15-19(14-17-10-12-18(13-11-17)27(32)33-4)25-22(16-20)24(26(30)31)21-8-6-7-9-23(21)29-25/h6-14,20H,5,15-16H2,1-4H3,(H,30,31)