1-cyclohexyl-3-ethynyl-5-(4-phenylmethoxyphenyl)pyrazole

Systemtic Name: 1-cyclohexyl-3-ethynyl-5-(4-phenylmethoxyphenyl)pyrazole Openeye Name: 5-(4-benzyloxyphenyl)-1-cyclohexyl-3-ethynyl-pyrazole CAS Name: 1-cyclohexyl-3-ethynyl-5-(4-phenylmethoxyphenyl)pyrazole IUPAC Name: 1-cyclohexyl-3-ethynyl-5-(4-phenylmethoxyphenyl)pyrazole Traditional Name: 5-(4-benzoxyphenyl)-1-cyclohexyl-3-ethynyl-pyrazole Formula: C24H24N2O MolecularWeight: 356.46016

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=NN(C(=C1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

C#CC1=NN(C(=C1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C24H24N2O/c1-2-21-17-24(26(25-21)22-11-7-4-8-12-22)20-13-15-23(16-14-20)27-18-19-9-5-3-6-10-19/h1,3,5-6,9-10,13-17,22H,4,7-8,11-12,18H2