3-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-N-octadecyl-propanamide

Systemtic Name: 3-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-2-methyl-N-octadecyl-propanamide Openeye Name: 3-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-2-methyl-N-octadecyl-propanamide CAS Name: 3-(4-chloro-3,5-dimethyl-1-pyrazolyl)-2-methyl-N-octadecylpropanamide IUPAC Name: 3-(4-chloro-3,5-dimethylpyrazol-1-yl)-2-methyl-N-octadecylpropanamide Traditional Name: 3-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-2-methyl-N-stearyl-propionamide Formula: C27H50ClN3O MolecularWeight: 468.1584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C(C)CN1C(=C(C(=N1)C)Cl)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C(C)CN1C(=C(C(=N1)C)Cl)C

InChI

InChI=1S/C27H50ClN3O/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-29-27(32)23(2)22-31-25(4)26(28)24(3)30-31/h23H,5-22H2,1-4H3,(H,29,32)