ethyl 1-[3-(1-methylpyrazol-4-yl)propanoyl]-4-phenethyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(1-methylpyrazol-4-yl)propanoyl]-4-phenethyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(1-methylpyrazol-4-yl)propanoyl]-4-phenethyl-piperidine-4-carboxylate CAS Name: 1-[3-(1-methyl-4-pyrazolyl)-1-oxopropyl]-4-phenethyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(1-methylpyrazol-4-yl)propanoyl]-4-phenethylpiperidine-4-carboxylate Traditional Name: 1-[3-(1-methylpyrazol-4-yl)propanoyl]-4-phenethyl-isonipecotic acid ethyl ester Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)CCC2=CN(N=C2)C)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)CCC2=CN(N=C2)C)CCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3/c1-3-29-22(28)23(12-11-19-7-5-4-6-8-19)13-15-26(16-14-23)21(27)10-9-20-17-24-25(2)18-20/h4-8,17-18H,3,9-16H2,1-2H3