2-cyclohexyl-4-ethyl-5-pyridin-3-yl-4H-pyrazol-3-one

Systemtic Name: 2-cyclohexyl-4-ethyl-5-pyridin-3-yl-4H-pyrazol-3-one Openeye Name: 2-cyclohexyl-4-ethyl-5-(3-pyridyl)-4H-pyrazol-3-one CAS Name: 2-cyclohexyl-4-ethyl-5-(3-pyridinyl)-4H-pyrazol-3-one IUPAC Name: 2-cyclohexyl-4-ethyl-5-pyridin-3-yl-4H-pyrazol-3-one Traditional Name: 2-cyclohexyl-4-ethyl-5-(3-pyridyl)-2-pyrazolin-3-one Formula: C16H21N3O MolecularWeight: 271.35744

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=NN(C1=O)C2CCCCC2)C3=CN=CC=C3

Isomeric SMILES

CCC1C(=NN(C1=O)C2CCCCC2)C3=CN=CC=C3

InChI

InChI=1S/C16H21N3O/c1-2-14-15(12-7-6-10-17-11-12)18-19(16(14)20)13-8-4-3-5-9-13/h6-7,10-11,13-14H,2-5,8-9H2,1H3