ethyl 1-[[5-(2,5-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[5-(2,5-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyethyl)piperidine-4-carboxylate Openeye Name: ethyl 1-[[5-(2,5-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyethyl)piperidine-4-carboxylate CAS Name: 1-[[5-(2,5-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[5-(2,5-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyethyl)piperidine-4-carboxylate Traditional Name: 1-[[5-(2,5-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-4-(2-methoxyethyl)isonipecotic acid ethyl ester Formula: C23H33N3O3 MolecularWeight: 399.52642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=C(NN=C2)C3=C(C=CC(=C3)C)C)CCOC

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=C(NN=C2)C3=C(C=CC(=C3)C)C)CCOC

InChI

InChI=1S/C23H33N3O3/c1-5-29-22(27)23(10-13-28-4)8-11-26(12-9-23)16-19-15-24-25-21(19)20-14-17(2)6-7-18(20)3/h6-7,14-15H,5,8-13,16H2,1-4H3,(H,24,25)