4-iodanyl-1-methyl-N-octadecyl-pyrazole-3-carboxamide

Systemtic Name: 4-iodanyl-1-methyl-N-octadecyl-pyrazole-3-carboxamide Openeye Name: 4-iodo-1-methyl-N-octadecyl-pyrazole-3-carboxamide CAS Name: 4-iodo-1-methyl-N-octadecyl-3-pyrazolecarboxamide IUPAC Name: 4-iodo-1-methyl-N-octadecylpyrazole-3-carboxamide Traditional Name: 4-iodo-1-methyl-N-stearyl-pyrazole-3-carboxamide Formula: C23H42IN3O MolecularWeight: 503.50355

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=NN(C=C1I)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=NN(C=C1I)C

InChI

InChI=1S/C23H42IN3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-23(28)22-21(24)20-27(2)26-22/h20H,3-19H2,1-2H3,(H,25,28)