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

Systemtic Name: methyl 4-[[3-(1H-pyrazol-5-yl)piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3-(1H-pyrazol-5-yl)-1-piperidyl]methyl]benzoate CAS Name: 4-[[3-(1H-pyrazol-5-yl)-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(1H-pyrazol-5-yl)piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[3-(1H-pyrazol-5-yl)piperidino]methyl]benzoic acid methyl ester Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCCC(C2)C3=CC=NN3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCCC(C2)C3=CC=NN3

InChI

InChI=1S/C17H21N3O2/c1-22-17(21)14-6-4-13(5-7-14)11-20-10-2-3-15(12-20)16-8-9-18-19-16/h4-9,15H,2-3,10-12H2,1H3,(H,18,19)