3-(5-ethyl-2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)-1-[(4-fluorophenyl)methyl]-4-piperidin-1-yl-pyrrole-2,5-dione

Systemtic Name: 3-(5-ethyl-2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)-1-[(4-fluorophenyl)methyl]-4-piperidin-1-yl-pyrrole-2,5-dione Openeye Name: 3-(5-ethyl-2-methyl-3-oxo-1H-pyrazol-4-yl)-1-[(4-fluorophenyl)methyl]-4-(1-piperidyl)pyrrole-2,5-dione CAS Name: 3-(5-ethyl-2-methyl-3-oxo-1H-pyrazol-4-yl)-1-[(4-fluorophenyl)methyl]-4-(1-piperidinyl)pyrrole-2,5-dione IUPAC Name: 3-(5-ethyl-2-methyl-3-oxo-1H-pyrazol-4-yl)-1-[(4-fluorophenyl)methyl]-4-piperidin-1-ylpyrrole-2,5-dione Traditional Name: 3-(3-ethyl-5-keto-1-methyl-3-pyrazolin-4-yl)-1-(4-fluorobenzyl)-4-piperidino-3-pyrroline-2,5-quinone Formula: C22H25FN4O3 MolecularWeight: 412.457303

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N(N1)C)C2=C(C(=O)N(C2=O)CC3=CC=C(C=C3)F)N4CCCCC4

Isomeric SMILES

CCC1=C(C(=O)N(N1)C)C2=C(C(=O)N(C2=O)CC3=CC=C(C=C3)F)N4CCCCC4

InChI

InChI=1S/C22H25FN4O3/c1-3-16-17(20(28)25(2)24-16)18-19(26-11-5-4-6-12-26)22(30)27(21(18)29)13-14-7-9-15(23)10-8-14/h7-10,24H,3-6,11-13H2,1-2H3