(2R,4E)-2-tert-butyl-4-[(2,5-dimethylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (2R,4E)-2-tert-butyl-4-[(2,5-dimethylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (2R,4E)-2-tert-butyl-4-[(2,5-dimethylphenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (2R,4E)-2-tert-butyl-4-[(2,5-dimethylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate IUPAC Name: (2R,4E)-2-tert-butyl-4-[(2,5-dimethylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (2R,4E)-2-tert-butyl-4-(2,5-dimethylbenzylidene)-2,3-dihydro-1H-acridine-9-carboxylate Formula: C27H28NO2- MolecularWeight: 398.51672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=C2CC(CC3=C(C4=CC=CC=C4N=C23)C(=O)[O-])C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)/C=C/2\C[C@H](CC3=C(C4=CC=CC=C4N=C23)C(=O)[O-])C(C)(C)C

InChI

InChI=1S/C27H29NO2/c1-16-10-11-17(2)18(12-16)13-19-14-20(27(3,4)5)15-22-24(26(29)30)21-8-6-7-9-23(21)28-25(19)22/h6-13,20H,14-15H2,1-5H3,(H,29,30)/p-1/b19-13+/t20-/m1/s1