ethyl 1-(2-oxidanyl-2-phenyl-ethyl)-5-(piperidin-1-ylcarbonylamino)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(2-oxidanyl-2-phenyl-ethyl)-5-(piperidin-1-ylcarbonylamino)pyrazole-4-carboxylate Openeye Name: ethyl 1-(2-hydroxy-2-phenyl-ethyl)-5-(piperidine-1-carbonylamino)pyrazole-4-carboxylate CAS Name: 1-(2-hydroxy-2-phenylethyl)-5-[[oxo(1-piperidinyl)methyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-hydroxy-2-phenylethyl)-5-(piperidine-1-carbonylamino)pyrazole-4-carboxylate Traditional Name: 1-(2-hydroxy-2-phenyl-ethyl)-5-(piperidine-1-carbonylamino)pyrazole-4-carboxylic acid ethyl ester Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)CC(C2=CC=CC=C2)O)NC(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)CC(C2=CC=CC=C2)O)NC(=O)N3CCCCC3

InChI

InChI=1S/C20H26N4O4/c1-2-28-19(26)16-13-21-24(14-17(25)15-9-5-3-6-10-15)18(16)22-20(27)23-11-7-4-8-12-23/h3,5-6,9-10,13,17,25H,2,4,7-8,11-12,14H2,1H3,(H,22,27)