ethyl 5-(3-azabicyclo[2.2.1]heptan-3-ylmethyl)-1-(4-methoxyphenyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(3-azabicyclo[2.2.1]heptan-3-ylmethyl)-1-(4-methoxyphenyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-(3-azabicyclo[2.2.1]heptan-3-ylmethyl)-1-(4-methoxyphenyl)pyrazole-4-carboxylate CAS Name: 5-(3-azabicyclo[2.2.1]heptan-3-ylmethyl)-1-(4-methoxyphenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-azabicyclo[2.2.1]heptan-3-ylmethyl)-1-(4-methoxyphenyl)pyrazole-4-carboxylate Traditional Name: 5-(3-azabicyclo[2.2.1]heptan-3-ylmethyl)-1-(4-methoxyphenyl)pyrazole-4-carboxylic acid ethyl ester Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)OC)CN3CC4CCC3C4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)OC)CN3CC4CCC3C4

InChI

InChI=1S/C20H25N3O3/c1-3-26-20(24)18-11-21-23(15-6-8-17(25-2)9-7-15)19(18)13-22-12-14-4-5-16(22)10-14/h6-9,11,14,16H,3-5,10,12-13H2,1-2H3