[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] (4E)-4-(2-furylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-(2-furanylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-(2-furfurylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)COC(=O)C2=C3CCCC(=CC4=CC=CO4)C3=NC5=CC=CC=C52

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)COC(=O)C2=C3CCC/C(=C\C4=CC=CO4)/C3=NC5=CC=CC=C52

InChI

InChI=1S/C27H25N3O4/c28-17-27(12-3-4-13-27)30-23(31)16-34-26(32)24-20-9-1-2-11-22(20)29-25-18(7-5-10-21(24)25)15-19-8-6-14-33-19/h1-2,6,8-9,11,14-15H,3-5,7,10,12-13,16H2,(H,30,31)/b18-15+