[5-[(2-chloranyl-4-methoxy-phenoxy)methyl]-1H-pyrazol-3-yl]-[(3S)-3-oxidanylpiperidin-1-yl]methanone

Systemtic Name: [5-[(2-chloranyl-4-methoxy-phenoxy)methyl]-1H-pyrazol-3-yl]-[(3S)-3-oxidanylpiperidin-1-yl]methanone Openeye Name: [5-[(2-chloro-4-methoxy-phenoxy)methyl]-1H-pyrazol-3-yl]-[(3S)-3-hydroxy-1-piperidyl]methanone CAS Name: [5-[(2-chloro-4-methoxyphenoxy)methyl]-1H-pyrazol-3-yl]-[(3S)-3-hydroxy-1-piperidinyl]methanone IUPAC Name: [5-[(2-chloro-4-methoxyphenoxy)methyl]-1H-pyrazol-3-yl]-[(3S)-3-hydroxypiperidin-1-yl]methanone Traditional Name: [5-[(2-chloro-4-methoxy-phenoxy)methyl]-1H-pyrazol-3-yl]-[(3S)-3-hydroxypiperidino]methanone Formula: C17H20ClN3O4 MolecularWeight: 365.8114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC2=CC(=NN2)C(=O)N3CCCC(C3)O)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OCC2=CC(=NN2)C(=O)N3CCC[C@@H](C3)O)Cl

InChI

InChI=1S/C17H20ClN3O4/c1-24-13-4-5-16(14(18)8-13)25-10-11-7-15(20-19-11)17(23)21-6-2-3-12(22)9-21/h4-5,7-8,12,22H,2-3,6,9-10H2,1H3,(H,19,20)/t12-/m0/s1