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1-[(2-methylphenoxy)methyl]-N-octadecyl-pyrazole-3-carboxamide

1-[(2-methylphenoxy)methyl]-N-octadecyl-pyrazole-3-carboxamide

Systemtic Name:1-[(2-methylphenoxy)methyl]-N-octadecyl-pyrazole-3-carboxamide
Openeye Name:1-[(2-methylphenoxy)methyl]-N-octadecyl-pyrazole-3-carboxamide
CAS Name:1-[(2-methylphenoxy)methyl]-N-octadecyl-3-pyrazolecarboxamide
IUPAC Name:1-[(2-methylphenoxy)methyl]-N-octadecylpyrazole-3-carboxamide
Traditional Name:1-[(2-methylphenoxy)methyl]-N-stearyl-pyrazole-3-carboxamide
Formula: C30H49N3O2
MolecularWeight: 483.72896
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=NN(C=C1)COC2=CC=CC=C2C


Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=NN(C=C1)COC2=CC=CC=C2C


InChI

InChI=1S/C30H49N3O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-24-31-30(34)28-23-25-33(32-28)26-35-29-22-19-18-21-27(29)2/h18-19,21-23,25H,3-17,20,24,26H2,1-2H3,(H,31,34)


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