1-[(2,6-dimethoxyphenoxy)methyl]-N-octadecyl-pyrazole-3-carboxamide

Systemtic Name: 1-[(2,6-dimethoxyphenoxy)methyl]-N-octadecyl-pyrazole-3-carboxamide Openeye Name: 1-[(2,6-dimethoxyphenoxy)methyl]-N-octadecyl-pyrazole-3-carboxamide CAS Name: 1-[(2,6-dimethoxyphenoxy)methyl]-N-octadecyl-3-pyrazolecarboxamide IUPAC Name: 1-[(2,6-dimethoxyphenoxy)methyl]-N-octadecylpyrazole-3-carboxamide Traditional Name: 1-[(2,6-dimethoxyphenoxy)methyl]-N-stearyl-pyrazole-3-carboxamide Formula: C31H51N3O4 MolecularWeight: 529.75434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=NN(C=C1)COC2=C(C=CC=C2OC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=NN(C=C1)COC2=C(C=CC=C2OC)OC

InChI

InChI=1S/C31H51N3O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-32-31(35)27-23-25-34(33-27)26-38-30-28(36-2)21-20-22-29(30)37-3/h20-23,25H,4-19,24,26H2,1-3H3,(H,32,35)