(2R,4E)-2-tert-butyl-4-[(4-cyanophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (2R,4E)-2-tert-butyl-4-[(4-cyanophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (2R,4E)-2-tert-butyl-4-[(4-cyanophenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (2R,4E)-2-tert-butyl-4-[(4-cyanophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate IUPAC Name: (2R,4E)-2-tert-butyl-4-[(4-cyanophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (2R,4E)-2-tert-butyl-4-(4-cyanobenzylidene)-2,3-dihydro-1H-acridine-9-carboxylate Formula: C26H23N2O2- MolecularWeight: 395.47302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24N2O2/c1-26(2,3)19-13-18(12-16-8-10-17(15-27)11-9-16)24-21(14-19)23(25(29)30)20-6-4-5-7-22(20)28-24/h4-12,19H,13-14H2,1-3H3,(H,29,30)/p-1/b18-12+/t19-/m1/s1