(4-tert-butylphenyl)methyl 3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

Systemtic Name: (4-tert-butylphenyl)methyl 3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Openeye Name: (4-tert-butylphenyl)methyl 3-(2-furylmethylene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate CAS Name: 3-(2-furanylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Traditional Name: 3-(2-furfurylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid (4-tert-butylbenzyl) ester Formula: C29H27NO3 MolecularWeight: 437.52958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=C3CCC(=CC4=CC=CO4)C3=NC5=CC=CC=C52

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=C3CCC(=CC4=CC=CO4)C3=NC5=CC=CC=C52

InChI

InChI=1S/C29H27NO3/c1-29(2,3)21-13-10-19(11-14-21)18-33-28(31)26-23-8-4-5-9-25(23)30-27-20(12-15-24(26)27)17-22-7-6-16-32-22/h4-11,13-14,16-17H,12,15,18H2,1-3H3