ethyl 1-[1-(2-fluorophenyl)carbonylpiperidin-4-yl]-5-(4-methoxyphenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[1-(2-fluorophenyl)carbonylpiperidin-4-yl]-5-(4-methoxyphenyl)pyrazole-3-carboxylate Openeye Name: ethyl 1-[1-(2-fluorobenzoyl)-4-piperidyl]-5-(4-methoxyphenyl)pyrazole-3-carboxylate CAS Name: 1-[1-[(2-fluorophenyl)-oxomethyl]-4-piperidinyl]-5-(4-methoxyphenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(2-fluorobenzoyl)piperidin-4-yl]-5-(4-methoxyphenyl)pyrazole-3-carboxylate Traditional Name: 1-[1-(2-fluorobenzoyl)-4-piperidyl]-5-(4-methoxyphenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C25H26FN3O4 MolecularWeight: 451.490043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)OC)C3CCN(CC3)C(=O)C4=CC=CC=C4F

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)OC)C3CCN(CC3)C(=O)C4=CC=CC=C4F

InChI

InChI=1S/C25H26FN3O4/c1-3-33-25(31)22-16-23(17-8-10-19(32-2)11-9-17)29(27-22)18-12-14-28(15-13-18)24(30)20-6-4-5-7-21(20)26/h4-11,16,18H,3,12-15H2,1-2H3