methyl 1-[3-[4-[[(1-ethylpyrazol-4-yl)methylamino]methyl]phenoxy]-2-oxidanyl-propyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[3-[4-[[(1-ethylpyrazol-4-yl)methylamino]methyl]phenoxy]-2-oxidanyl-propyl]piperidine-4-carboxylate Openeye Name: methyl 1-[3-[4-[[(1-ethylpyrazol-4-yl)methylamino]methyl]phenoxy]-2-hydroxy-propyl]piperidine-4-carboxylate CAS Name: 1-[3-[4-[[(1-ethyl-4-pyrazolyl)methylamino]methyl]phenoxy]-2-hydroxypropyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-[4-[[(1-ethylpyrazol-4-yl)methylamino]methyl]phenoxy]-2-hydroxypropyl]piperidine-4-carboxylate Traditional Name: 1-[3-[4-[[(1-ethylpyrazol-4-yl)methylamino]methyl]phenoxy]-2-hydroxy-propyl]isonipecotic acid methyl ester Formula: C23H34N4O4 MolecularWeight: 430.54046

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CNCC2=CC=C(C=C2)OCC(CN3CCC(CC3)C(=O)OC)O

Isomeric SMILES

CCN1C=C(C=N1)CNCC2=CC=C(C=C2)OCC(CN3CCC(CC3)C(=O)OC)O

InChI

InChI=1S/C23H34N4O4/c1-3-27-15-19(14-25-27)13-24-12-18-4-6-22(7-5-18)31-17-21(28)16-26-10-8-20(9-11-26)23(29)30-2/h4-7,14-15,20-21,24,28H,3,8-13,16-17H2,1-2H3