methyl 4-[[1-(3-fluorophenyl)-5-piperidin-4-yl-pyrazol-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-(3-fluorophenyl)-5-piperidin-4-yl-pyrazol-4-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-(3-fluorophenyl)-5-(4-piperidyl)pyrazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[1-(3-fluorophenyl)-5-(4-piperidinyl)-4-pyrazolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(3-fluorophenyl)-5-piperidin-4-ylpyrazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(3-fluorophenyl)-5-(4-piperidyl)pyrazole-4-carbonyl]amino]benzoic acid methyl ester Formula: C23H23FN4O3 MolecularWeight: 422.452123

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC(=CC=C3)F)C4CCNCC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(N=C2)C3=CC(=CC=C3)F)C4CCNCC4

InChI

InChI=1S/C23H23FN4O3/c1-31-23(30)16-5-7-18(8-6-16)27-22(29)20-14-26-28(19-4-2-3-17(24)13-19)21(20)15-9-11-25-12-10-15/h2-8,13-15,25H,9-12H2,1H3,(H,27,29)