ethyl 4-[(3-methoxyphenyl)methyl]-1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(3-isobutyl-1H-pyrazol-5-yl)methyl]-4-[(3-methoxyphenyl)methyl]piperidine-4-carboxylate CAS Name: 4-[(3-methoxyphenyl)methyl]-1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]piperidine-4-carboxylate Traditional Name: 1-[(3-isobutyl-1H-pyrazol-5-yl)methyl]-4-m-anisyl-isonipecotic acid ethyl ester Formula: C24H35N3O3 MolecularWeight: 413.553

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=CC(=NN2)CC(C)C)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=CC(=NN2)CC(C)C)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C24H35N3O3/c1-5-30-23(28)24(16-19-7-6-8-22(14-19)29-4)9-11-27(12-10-24)17-21-15-20(25-26-21)13-18(2)3/h6-8,14-15,18H,5,9-13,16-17H2,1-4H3,(H,25,26)