ethyl 1-[(2,4-dimethyl-6-pyrazol-1-yl-phenyl)methyl]-3-(2-methoxyethyl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(2,4-dimethyl-6-pyrazol-1-yl-phenyl)methyl]-3-(2-methoxyethyl)piperidine-3-carboxylate Openeye Name: ethyl 1-[(2,4-dimethyl-6-pyrazol-1-yl-phenyl)methyl]-3-(2-methoxyethyl)piperidine-3-carboxylate CAS Name: 1-[[2,4-dimethyl-6-(1-pyrazolyl)phenyl]methyl]-3-(2-methoxyethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2,4-dimethyl-6-pyrazol-1-ylphenyl)methyl]-3-(2-methoxyethyl)piperidine-3-carboxylate Traditional Name: 1-(2,4-dimethyl-6-pyrazol-1-yl-benzyl)-3-(2-methoxyethyl)nipecotic acid ethyl ester Formula: C23H33N3O3 MolecularWeight: 399.52642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)CC2=C(C=C(C=C2N3C=CC=N3)C)C)CCOC

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)CC2=C(C=C(C=C2N3C=CC=N3)C)C)CCOC

InChI

InChI=1S/C23H33N3O3/c1-5-29-22(27)23(9-13-28-4)8-6-11-25(17-23)16-20-19(3)14-18(2)15-21(20)26-12-7-10-24-26/h7,10,12,14-15H,5-6,8-9,11,13,16-17H2,1-4H3