(2S,4E)-2-(2-methylbutan-2-yl)-4-[(4-propan-2-ylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (2S,4E)-2-(2-methylbutan-2-yl)-4-[(4-propan-2-ylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (2S,4E)-2-(1,1-dimethylpropyl)-4-[(4-isopropylphenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (2S,4E)-2-(2-methylbutan-2-yl)-4-[(4-propan-2-ylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate IUPAC Name: (2S,4E)-2-(2-methylbutan-2-yl)-4-[(4-propan-2-ylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (2S,4E)-2-tert-amyl-4-(4-isopropylbenzylidene)-2,3-dihydro-1H-acridine-9-carboxylate Formula: C29H32NO2- MolecularWeight: 426.56988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(C)(C)[C@H]1C/C(=C\C2=CC=C(C=C2)C(C)C)/C3=NC4=CC=CC=C4C(=C3C1)C(=O)[O-]

InChI

InChI=1S/C29H33NO2/c1-6-29(4,5)22-16-21(15-19-11-13-20(14-12-19)18(2)3)27-24(17-22)26(28(31)32)23-9-7-8-10-25(23)30-27/h7-15,18,22H,6,16-17H2,1-5H3,(H,31,32)/p-1/b21-15+/t22-/m0/s1