ethyl 5-[[2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[2-(2-furylmethyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[[2-(2-furanylmethyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carbonyl]amino]-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-[[2-(2-furfuryl)-1,3-diketo-isoindoline-5-carbonyl]amino]-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C29H21N5O6 MolecularWeight: 535.50694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)CC6=CC=CO6

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)CC6=CC=CO6

InChI

InChI=1S/C29H21N5O6/c1-2-39-29(38)22-15-30-34(24-12-10-17-6-3-4-8-23(17)31-24)25(22)32-26(35)18-9-11-20-21(14-18)28(37)33(27(20)36)16-19-7-5-13-40-19/h3-15H,2,16H2,1H3,(H,32,35)