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

Systemtic Name: 2-(2-methylbutan-2-yl)-4-[(3-phenylmethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Openeye Name: 4-[(3-benzyloxyphenyl)methylene]-2-(1,1-dimethylpropyl)-2,3-dihydro-1H-acridine-9-carboxylic acid CAS Name: 2-(2-methylbutan-2-yl)-4-[(3-phenylmethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid IUPAC Name: 2-(2-methylbutan-2-yl)-4-[(3-phenylmethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Traditional Name: 2-tert-amyl-4-(3-benzoxybenzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid Formula: C33H33NO3 MolecularWeight: 491.62002

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CC(=CC2=CC(=CC=C2)OCC3=CC=CC=C3)C4=NC5=CC=CC=C5C(=C4C1)C(=O)O

Isomeric SMILES

CCC(C)(C)C1CC(=CC2=CC(=CC=C2)OCC3=CC=CC=C3)C4=NC5=CC=CC=C5C(=C4C1)C(=O)O

InChI

InChI=1S/C33H33NO3/c1-4-33(2,3)25-19-24(17-23-13-10-14-26(18-23)37-21-22-11-6-5-7-12-22)31-28(20-25)30(32(35)36)27-15-8-9-16-29(27)34-31/h5-18,25H,4,19-21H2,1-3H3,(H,35,36)