(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-(phenylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-(phenylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-benzylidene-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate CAS Name: 3-(phenylmethylene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-benzylidene-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate Traditional Name: 3-benzal-1,2-dihydrocyclopenta[b]quinoline-9-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C29H22N2O6 MolecularWeight: 494.49478

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C3N=C2C1=CC4=CC=CC=C4)C(=O)OCC5=C6C(=CC(=C5)[N+](=O)[O-])COCO6

Isomeric SMILES

C1CC2=C(C3=CC=CC=C3N=C2C1=CC4=CC=CC=C4)C(=O)OCC5=C6C(=CC(=C5)[N+](=O)[O-])COCO6

InChI

InChI=1S/C29H22N2O6/c32-29(36-16-21-14-22(31(33)34)13-20-15-35-17-37-28(20)21)26-23-8-4-5-9-25(23)30-27-19(10-11-24(26)27)12-18-6-2-1-3-7-18/h1-9,12-14H,10-11,15-17H2