[(1R)-1-cyanoethyl] (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [(1R)-1-cyanoethyl] (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [(1R)-1-cyanoethyl] (4Z)-4-(1,3-benzodioxol-5-ylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4Z)-4-piperonylidene-2,3-dihydro-1H-acridine-9-carboxylic acid [(1R)-1-cyanoethyl] ester Formula: C25H20N2O4 MolecularWeight: 412.4373

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=C2CCCC(=CC3=CC4=C(C=C3)OCO4)C2=NC5=CC=CC=C51

Isomeric SMILES

C[C@H](C#N)OC(=O)C1=C2CCC/C(=C/C3=CC4=C(C=C3)OCO4)/C2=NC5=CC=CC=C51

InChI

InChI=1S/C25H20N2O4/c1-15(13-26)31-25(28)23-18-6-2-3-8-20(18)27-24-17(5-4-7-19(23)24)11-16-9-10-21-22(12-16)30-14-29-21/h2-3,6,8-12,15H,4-5,7,14H2,1H3/b17-11-/t15-/m1/s1