ethyl 5-[[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-1-(4-methoxyphenyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-1-(4-methoxyphenyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-1-(4-methoxyphenyl)pyrazole-4-carboxylate CAS Name: 5-[[(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]methyl]-1-(4-methoxyphenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]methyl]-1-(4-methoxyphenyl)pyrazole-4-carboxylate Traditional Name: 1-(4-methoxyphenyl)-5-[[(2S)-2-methylolpyrrolidino]methyl]pyrazole-4-carboxylic acid ethyl ester Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)OC)CN3CCCC3CO

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)OC)CN3CCC[C@H]3CO

InChI

InChI=1S/C19H25N3O4/c1-3-26-19(24)17-11-20-22(14-6-8-16(25-2)9-7-14)18(17)12-21-10-4-5-15(21)13-23/h6-9,11,15,23H,3-5,10,12-13H2,1-2H3/t15-/m0/s1