(2-cyanophenyl)methyl 3-(1,3-benzodioxol-5-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

Systemtic Name: (2-cyanophenyl)methyl 3-(1,3-benzodioxol-5-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Openeye Name: (2-cyanophenyl)methyl 3-(1,3-benzodioxol-5-ylmethylene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate CAS Name: 3-(1,3-benzodioxol-5-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 3-(1,3-benzodioxol-5-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Traditional Name: 3-piperonylidene-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid (2-cyanobenzyl) ester Formula: C29H20N2O4 MolecularWeight: 460.4801

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C3N=C2C1=CC4=CC5=C(C=C4)OCO5)C(=O)OCC6=CC=CC=C6C#N

Isomeric SMILES

C1CC2=C(C3=CC=CC=C3N=C2C1=CC4=CC5=C(C=C4)OCO5)C(=O)OCC6=CC=CC=C6C#N

InChI

InChI=1S/C29H20N2O4/c30-15-20-5-1-2-6-21(20)16-33-29(32)27-22-7-3-4-8-24(22)31-28-19(10-11-23(27)28)13-18-9-12-25-26(14-18)35-17-34-25/h1-9,12-14H,10-11,16-17H2