ethyl (3S)-1-[[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazol-3-yl]carbonyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazole-3-carbonyl]piperidine-3-carboxylate CAS Name: (3S)-1-[[5-[(3,5-dimethyl-1-pyrazolyl)methyl]-1H-pyrazol-3-yl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazole-3-carbonyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[5-[(3,5-dimethylpyrazol-1-yl)methyl]-1H-pyrazole-3-carbonyl]nipecotic acid ethyl ester Formula: C18H25N5O3 MolecularWeight: 359.4228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=NNC(=C2)CN3C(=CC(=N3)C)C

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)C2=NNC(=C2)CN3C(=CC(=N3)C)C

InChI

InChI=1S/C18H25N5O3/c1-4-26-18(25)14-6-5-7-22(10-14)17(24)16-9-15(19-20-16)11-23-13(3)8-12(2)21-23/h8-9,14H,4-7,10-11H2,1-3H3,(H,19,20)/t14-/m0/s1