ethyl 1-[2-ethyl-5-(2-methoxyphenyl)pyrazol-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-ethyl-5-(2-methoxyphenyl)pyrazol-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[2-ethyl-5-(2-methoxyphenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[2-ethyl-5-(2-methoxyphenyl)-3-pyrazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-ethyl-5-(2-methoxyphenyl)pyrazole-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[2-ethyl-5-(2-methoxyphenyl)pyrazole-3-carbonyl]nipecotic acid ethyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C2=CC=CC=C2OC)C(=O)N3CCCC(C3)C(=O)OCC

Isomeric SMILES

CCN1C(=CC(=N1)C2=CC=CC=C2OC)C(=O)N3CCCC(C3)C(=O)OCC

InChI

InChI=1S/C21H27N3O4/c1-4-24-18(13-17(22-24)16-10-6-7-11-19(16)27-3)20(25)23-12-8-9-15(14-23)21(26)28-5-2/h6-7,10-11,13,15H,4-5,8-9,12,14H2,1-3H3