(3-nitrophenyl)methyl 4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (3-nitrophenyl)methyl 4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (3-nitrophenyl)methyl 4-(1,3-benzodioxol-5-ylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: 4-piperonylidene-2,3-dihydro-1H-acridine-9-carboxylic acid (3-nitrobenzyl) ester Formula: C29H22N2O6 MolecularWeight: 494.49478

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5C(=C4C1)C(=O)OCC6=CC(=CC=C6)[N+](=O)[O-]

Isomeric SMILES

C1CC(=CC2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5C(=C4C1)C(=O)OCC6=CC(=CC=C6)[N+](=O)[O-]

InChI

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