2-oxidanylidenepropyl (3E)-3-[(4-tert-butylphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

Systemtic Name: 2-oxidanylidenepropyl (3E)-3-[(4-tert-butylphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Openeye Name: acetonyl (3E)-3-[(4-tert-butylphenyl)methylene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate CAS Name: (3E)-3-[(4-tert-butylphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl (3E)-3-[(4-tert-butylphenyl)methylidene]-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Traditional Name: (3E)-3-(4-tert-butylbenzylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid acetonyl ester Formula: C27H27NO3 MolecularWeight: 413.50818

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1=C2CCC(=CC3=CC=C(C=C3)C(C)(C)C)C2=NC4=CC=CC=C41

Isomeric SMILES

CC(=O)COC(=O)C1=C2CC/C(=C\C3=CC=C(C=C3)C(C)(C)C)/C2=NC4=CC=CC=C41

InChI

InChI=1S/C27H27NO3/c1-17(29)16-31-26(30)24-21-7-5-6-8-23(21)28-25-19(11-14-22(24)25)15-18-9-12-20(13-10-18)27(2,3)4/h5-10,12-13,15H,11,14,16H2,1-4H3/b19-15+