cyanomethyl (4E)-4-[(4-tert-butylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: cyanomethyl (4E)-4-[(4-tert-butylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: cyanomethyl (4E)-4-[(4-tert-butylphenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-[(4-tert-butylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl (4E)-4-[(4-tert-butylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-(4-tert-butylbenzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid cyanomethyl ester Formula: C27H26N2O2 MolecularWeight: 410.50754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=C2CCCC3=C(C4=CC=CC=C4N=C23)C(=O)OCC#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C/2\CCCC3=C(C4=CC=CC=C4N=C23)C(=O)OCC#N

InChI

InChI=1S/C27H26N2O2/c1-27(2,3)20-13-11-18(12-14-20)17-19-7-6-9-22-24(26(30)31-16-15-28)21-8-4-5-10-23(21)29-25(19)22/h4-5,8,10-14,17H,6-7,9,16H2,1-3H3/b19-17+