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

Systemtic Name: ethyl 5-[[2-cyclohexyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(2-cyclohexyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[(2-cyclohexyl-1,3-dioxo-5-isoindolyl)-oxomethyl]amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-cyclohexyl-1,3-dioxoisoindole-5-carbonyl)amino]-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-[(2-cyclohexyl-1,3-diketo-isoindoline-5-carbonyl)amino]-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C30H27N5O5 MolecularWeight: 537.56588

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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)C6CCCCC6

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)C6CCCCC6

InChI

InChI=1S/C30H27N5O5/c1-2-40-30(39)23-17-31-35(25-15-13-18-8-6-7-11-24(18)32-25)26(23)33-27(36)19-12-14-21-22(16-19)29(38)34(28(21)37)20-9-4-3-5-10-20/h6-8,11-17,20H,2-5,9-10H2,1H3,(H,33,36)