[(1S)-2-oxidanylidenecyclopentyl] (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [(1S)-2-oxidanylidenecyclopentyl] (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [(1S)-2-oxocyclopentyl] (4E)-4-(1,3-benzodioxol-5-ylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [(1S)-2-oxocyclopentyl] ester IUPAC Name: [(1S)-2-oxocyclopentyl] (4E)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-piperonylidene-2,3-dihydro-1H-acridine-9-carboxylic acid [(1S)-2-ketocyclopentyl] ester Formula: C27H23NO5 MolecularWeight: 441.47522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C1)OC(=O)C2=C3CCCC(=CC4=CC5=C(C=C4)OCO5)C3=NC6=CC=CC=C62

Isomeric SMILES

C1C[C@@H](C(=O)C1)OC(=O)C2=C3CCC/C(=C\C4=CC5=C(C=C4)OCO5)/C3=NC6=CC=CC=C62

InChI

InChI=1S/C27H23NO5/c29-21-9-4-10-22(21)33-27(30)25-18-6-1-2-8-20(18)28-26-17(5-3-7-19(25)26)13-16-11-12-23-24(14-16)32-15-31-23/h1-2,6,8,11-14,22H,3-5,7,9-10,15H2/b17-13+/t22-/m0/s1