N-(4-oxidanylcyclohexyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(4-oxidanylcyclohexyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(4-hydroxycyclohexyl)pyrazole-4-carboxamide CAS Name: N-(4-hydroxycyclohexyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(4-hydroxycyclohexyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(4-hydroxycyclohexyl)pyrazole-4-carboxamide Formula: C17H21N3O2 MolecularWeight: 299.36754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2=CN(N=C2)CC3=CC=CC=C3)O

Isomeric SMILES

C1CC(CCC1NC(=O)C2=CN(N=C2)CC3=CC=CC=C3)O

InChI

InChI=1S/C17H21N3O2/c21-16-8-6-15(7-9-16)19-17(22)14-10-18-20(12-14)11-13-4-2-1-3-5-13/h1-5,10,12,15-16,21H,6-9,11H2,(H,19,22)