ethyl 4-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]amino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[2-(4-ethylbenzyl)pyrazol-3-yl]carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C21H28N4O3/c1-3-16-5-7-17(8-6-16)15-25-19(9-12-22-25)23-20(26)18-10-13-24(14-11-18)21(27)28-4-2/h5-9,12,18H,3-4,10-11,13-15H2,1-2H3,(H,23,26)