ethyl 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-(2-phenoxyethyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-(2-phenoxyethyl)piperidine-4-carboxylate Openeye Name: ethyl 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-(2-phenoxyethyl)piperidine-4-carboxylate CAS Name: 1-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-4-(2-phenoxyethyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-4-(2-phenoxyethyl)piperidine-4-carboxylate Traditional Name: 1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-4-(2-phenoxyethyl)isonipecotic acid ethyl ester Formula: C23H33N3O3 MolecularWeight: 399.52642

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CN2CCC(CC2)(CCOC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=N1)C)CN2CCC(CC2)(CCOC3=CC=CC=C3)C(=O)OCC

InChI

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